N-[2-[(phenylmethyl)-propan-2-yl-amino]ethyl]-4-(phenylsulfonylaminomethyl)cyclohexane-1-carboxamide

Systemtic Name: N-[2-[(phenylmethyl)-propan-2-yl-amino]ethyl]-4-(phenylsulfonylaminomethyl)cyclohexane-1-carboxamide Openeye Name: 4-(benzenesulfonamidomethyl)-N-[2-[benzyl(isopropyl)amino]ethyl]cyclohexanecarboxamide CAS Name: 4-(benzenesulfonamidomethyl)-N-[2-[(phenylmethyl)-propan-2-ylamino]ethyl]-1-cyclohexanecarboxamide IUPAC Name: 4-(benzenesulfonamidomethyl)-N-[2-[benzyl(propan-2-yl)amino]ethyl]cyclohexane-1-carboxamide Traditional Name: 4-(benzenesulfonamidomethyl)-N-[2-[benzyl(isopropyl)amino]ethyl]cyclohexanecarboxamide Formula: C26H37N3O3S MolecularWeight: 471.65528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCNC(=O)C1CCC(CC1)CNS(=O)(=O)C2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)N(CCNC(=O)C1CCC(CC1)CNS(=O)(=O)C2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C26H37N3O3S/c1-21(2)29(20-23-9-5-3-6-10-23)18-17-27-26(30)24-15-13-22(14-16-24)19-28-33(31,32)25-11-7-4-8-12-25/h3-12,21-22,24,28H,13-20H2,1-2H3,(H,27,30)