IUPAC Traditional

N-{[4-benzyl-5-({2-[5-(4-methoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}benzamide

Compound number MolPort-018-150-006
Molecular weight 622.76
InChI key DBFWHGTVEZEDEQ-UHFFFAOYSA-N
Molecular formula C33H30N6O3S2
DMSO Solubility Unknown
SMILES COc1ccc(cc1)C1CC(=NN1C(=O)CSc1nnc(CNC(=O)c2ccccc2)n1Cc1ccccc1)c1cccs1 |w:8.8,c:11|
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More Information

Compound identifiers

Compound number
MolPort-018-150-006

Names, Synonyms and 3rd Party Identifiers

InChI

InChI
1/C33H30N6O3S2/c1-42-26-16-14-24(15-17-26)28-19-27(29-13-8-18-43-29)37-39(28)31(40)22-44-33-36-35-30(38(33)21-23-9-4-2-5-10-23)20-34-32(41)25-11-6-3-7-12-25/h2-18,28H,19-22H2,1H3,(H,34,41)
InChI key
DBFWHGTVEZEDEQ-UHFFFAOYSA-N

Formula

Molecular formula
C33H30N6O3S2
Molecular weight
622.76

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