N-cyclohexyl-1-[(4-ethylphenyl)methyl]-2-methyl-6-oxidanylidene-4-(phenylsulfonyl)piperazine-2-carboxamide

Systemtic Name: N-cyclohexyl-1-[(4-ethylphenyl)methyl]-2-methyl-6-oxidanylidene-4-(phenylsulfonyl)piperazine-2-carboxamide Openeye Name: 4-(benzenesulfonyl)-N-cyclohexyl-1-[(4-ethylphenyl)methyl]-2-methyl-6-oxo-piperazine-2-carboxamide CAS Name: 4-(benzenesulfonyl)-N-cyclohexyl-1-[(4-ethylphenyl)methyl]-2-methyl-6-oxo-2-piperazinecarboxamide IUPAC Name: 4-(benzenesulfonyl)-N-cyclohexyl-1-[(4-ethylphenyl)methyl]-2-methyl-6-oxopiperazine-2-carboxamide Traditional Name: 4-besyl-N-cyclohexyl-1-(4-ethylbenzyl)-6-keto-2-methyl-piperazine-2-carboxamide Formula: C27H35N3O4S MolecularWeight: 497.6495

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2C(=O)CN(CC2(C)C(=O)NC3CCCCC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)CN2C(=O)CN(CC2(C)C(=O)NC3CCCCC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H35N3O4S/c1-3-21-14-16-22(17-15-21)18-30-25(31)19-29(35(33,34)24-12-8-5-9-13-24)20-27(30,2)26(32)28-23-10-6-4-7-11-23/h5,8-9,12-17,23H,3-4,6-7,10-11,18-20H2,1-2H3,(H,28,32)