1-(3,5-dimethylphenyl)-2-methyl-N-(3-methylbutyl)-6-oxidanylidene-4-(phenylsulfonyl)piperazine-2-carboxamide

Systemtic Name: 1-(3,5-dimethylphenyl)-2-methyl-N-(3-methylbutyl)-6-oxidanylidene-4-(phenylsulfonyl)piperazine-2-carboxamide Openeye Name: 4-(benzenesulfonyl)-1-(3,5-dimethylphenyl)-N-isopentyl-2-methyl-6-oxo-piperazine-2-carboxamide CAS Name: 4-(benzenesulfonyl)-1-(3,5-dimethylphenyl)-2-methyl-N-(3-methylbutyl)-6-oxo-2-piperazinecarboxamide IUPAC Name: 4-(benzenesulfonyl)-1-(3,5-dimethylphenyl)-2-methyl-N-(3-methylbutyl)-6-oxopiperazine-2-carboxamide Traditional Name: 4-besyl-1-(3,5-dimethylphenyl)-N-isoamyl-6-keto-2-methyl-piperazine-2-carboxamide Formula: C25H33N3O4S MolecularWeight: 471.61222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=O)CN(CC2(C)C(=O)NCCC(C)C)S(=O)(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=O)CN(CC2(C)C(=O)NCCC(C)C)S(=O)(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C25H33N3O4S/c1-18(2)11-12-26-24(30)25(5)17-27(33(31,32)22-9-7-6-8-10-22)16-23(29)28(25)21-14-19(3)13-20(4)15-21/h6-10,13-15,18H,11-12,16-17H2,1-5H3,(H,26,30)