1-(2,3-dimethylphenyl)-4-(2,4-dimethylphenyl)-3-[4-(propan-2-yl)phenyl]piperazine-2,5-dione

Compound number:
MolPort-039-070-416
IUPAC:
1-(2,3-dimethylphenyl)-4-(2,4-dimethylphenyl)-3-[4-(propan-2-yl)phenyl]piperazine-2,5-dione
IUPAC traditional:
1-(2,3-dimethylphenyl)-4-(2,4-dimethylphenyl)-3-(4-isopropylphenyl)piperazine-2,5-dione
SMILES:
CC(C)c1ccc(cc1)C1N(C(=O)CN(C1=O)c1cccc(C)c1C)c1ccc(C)cc1C
InChI key:
SHBXTTNGXUQLFX-UHFFFAOYSA-N
Molecular formula:
C29H32N2O2
Molecular weight: 440.587
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Compound Identifiers
Compound number: MolPort-039-070-416

Names, Synonyms and 3rd Party Identifiers
Name: ZINC000015412587
ZINC000015412590
1-(2,3-dimethylphenyl)-4-(2,4-dimethylphenyl)-3-(4-isopropylphenyl)-2,5-piperazinedione

InChI
InChI: 1S/C29H32N2O2/c1-18(2)23-11-13-24(14-12-23)28-29(33)30(26-9-7-8-20(4)22(26)6)17-27(32)31(28)25-15-10-19(3)16-21(25)5/h7-16,18,28H,17H2,1-6H3
InChI key: SHBXTTNGXUQLFX-UHFFFAOYSA-N

Calculated Properties
Molecular formula: C29H32N2O2
Molecular weight: 440.587

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2019 MolPort, v3.22, release date 14-10-2019 15:00 (+0200). All rights reserved.
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