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

Systemtic Name: N-[(2S)-3-methyl-1-[methyl-(phenylmethyl)amino]-1-oxidanylidene-butan-2-yl]-4-(phenylsulfonylaminomethyl)cyclohexane-1-carboxamide Openeye Name: 4-(benzenesulfonamidomethyl)-N-[(1S)-1-[benzyl(methyl)carbamoyl]-2-methyl-propyl]cyclohexanecarboxamide CAS Name: 4-(benzenesulfonamidomethyl)-N-[(2S)-3-methyl-1-[methyl-(phenylmethyl)amino]-1-oxobutan-2-yl]-1-cyclohexanecarboxamide IUPAC Name: 4-(benzenesulfonamidomethyl)-N-[(2S)-1-[benzyl(methyl)amino]-3-methyl-1-oxobutan-2-yl]cyclohexane-1-carboxamide Traditional Name: 4-(benzenesulfonamidomethyl)-N-[(1S)-1-[benzyl(methyl)carbamoyl]-2-methyl-propyl]cyclohexanecarboxamide Formula: C27H37N3O4S MolecularWeight: 499.66538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N(C)CC1=CC=CC=C1)NC(=O)C2CCC(CC2)CNS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H](C(=O)N(C)CC1=CC=CC=C1)NC(=O)C2CCC(CC2)CNS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C27H37N3O4S/c1-20(2)25(27(32)30(3)19-22-10-6-4-7-11-22)29-26(31)23-16-14-21(15-17-23)18-28-35(33,34)24-12-8-5-9-13-24/h4-13,20-21,23,25,28H,14-19H2,1-3H3,(H,29,31)/t21?,23?,25-/m0/s1