N-[(2S)-1-(cycloheptylamino)-3-methyl-1-oxidanylidene-butan-2-yl]-4-(phenylsulfonylaminomethyl)cyclohexane-1-carboxamide

Systemtic Name: N-[(2S)-1-(cycloheptylamino)-3-methyl-1-oxidanylidene-butan-2-yl]-4-(phenylsulfonylaminomethyl)cyclohexane-1-carboxamide Openeye Name: 4-(benzenesulfonamidomethyl)-N-[(1S)-1-(cycloheptylcarbamoyl)-2-methyl-propyl]cyclohexanecarboxamide CAS Name: 4-(benzenesulfonamidomethyl)-N-[(2S)-1-(cycloheptylamino)-3-methyl-1-oxobutan-2-yl]-1-cyclohexanecarboxamide IUPAC Name: 4-(benzenesulfonamidomethyl)-N-[(2S)-1-(cycloheptylamino)-3-methyl-1-oxobutan-2-yl]cyclohexane-1-carboxamide Traditional Name: 4-(benzenesulfonamidomethyl)-N-[(1S)-1-(cycloheptylcarbamoyl)-2-methyl-propyl]cyclohexanecarboxamide Formula: C26H41N3O4S MolecularWeight: 491.68644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1CCCCCC1)NC(=O)C2CCC(CC2)CNS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1CCCCCC1)NC(=O)C2CCC(CC2)CNS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C26H41N3O4S/c1-19(2)24(26(31)28-22-10-6-3-4-7-11-22)29-25(30)21-16-14-20(15-17-21)18-27-34(32,33)23-12-8-5-9-13-23/h5,8-9,12-13,19-22,24,27H,3-4,6-7,10-11,14-18H2,1-2H3,(H,28,31)(H,29,30)/t20?,21?,24-/m0/s1