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

Systemtic Name: N-cycloheptyl-1-(2,3-dimethylphenyl)-2-methyl-6-oxidanylidene-4-(phenylsulfonyl)piperazine-2-carboxamide Openeye Name: 4-(benzenesulfonyl)-N-cycloheptyl-1-(2,3-dimethylphenyl)-2-methyl-6-oxo-piperazine-2-carboxamide CAS Name: 4-(benzenesulfonyl)-N-cycloheptyl-1-(2,3-dimethylphenyl)-2-methyl-6-oxo-2-piperazinecarboxamide IUPAC Name: 4-(benzenesulfonyl)-N-cycloheptyl-1-(2,3-dimethylphenyl)-2-methyl-6-oxopiperazine-2-carboxamide Traditional Name: 4-besyl-N-cycloheptyl-1-(2,3-dimethylphenyl)-6-keto-2-methyl-piperazine-2-carboxamide Formula: C27H35N3O4S MolecularWeight: 497.6495

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C(=O)CN(CC2(C)C(=O)NC3CCCCCC3)S(=O)(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=O)CN(CC2(C)C(=O)NC3CCCCCC3)S(=O)(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C27H35N3O4S/c1-20-12-11-17-24(21(20)2)30-25(31)18-29(35(33,34)23-15-9-6-10-16-23)19-27(30,3)26(32)28-22-13-7-4-5-8-14-22/h6,9-12,15-17,22H,4-5,7-8,13-14,18-19H2,1-3H3,(H,28,32)