3-(ethylsulfanyl)-4-methyl-5-(4-nitrophenyl)-4H-1,2,4-triazole



Compound number:
MolPort-000-011-126
IUPAC:
3-(ethylsulfanyl)-4-methyl-5-(4-nitrophenyl)-4H-1,2,4-triazole
IUPAC traditional:
3-(ethylsulfanyl)-4-methyl-5-(4-nitrophenyl)-1,2,4-triazole
SMILES:
CCSc1nnc(-c2ccc(cc2)[N+]([O-])=O)n1C
InChI key:
VUIJNHDZRRRATP-UHFFFAOYSA-N
Molecular formula:
C11H12N4O2S
Molecular weight: 264.3
Solubility: not available

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Catalog: Screening compound Ships out: 2 business days Purity: n/a
Last updated: this month In warehouse: Unverified
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Catalog: Screening compound Ships out: 6 business days Purity: 90+% BY 1H NMR
Last updated: > 3 months ago In warehouse: Unverified Salt: free
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10 mg May 25, 2021 30.00 USD
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Direct S&H to USA: 55.00 USD
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Catalog: Building blocks Ships out: 15 business days Purity: >95%
Last updated: this month In warehouse: 1000.00 mg
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0.1 g June 7, 2021 264.00 USD
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0.25 g June 7, 2021 343.20 USD
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0.5 g June 7, 2021 446.15 USD
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More Information

Compound Identifiers
Compound number: MolPort-000-011-126

Names, Synonyms and 3rd Party Identifiers
Name: ZINC000000422057
3-(ethylsulfanyl)-4-methyl-5-(4-nitrophenyl)-4H-1,2,4-triazole
3-ethylthio-4-methyl-5-(4-nitrophenyl)-1,2,4-triazole
MFCD02589480

InChI
InChI: 1S/C11H12N4O2S/c1-3-18-11-13-12-10(14(11)2)8-4-6-9(7-5-8)15(16)17/h4-7H,3H2,1-2H3
InChI key: VUIJNHDZRRRATP-UHFFFAOYSA-N

Calculated Properties
Molecular formula: C11H12N4O2S
Molecular weight: 264.3

Other

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