N-[3-[butyl(phenyl)amino]propyl]-4-(phenylsulfonylaminomethyl)cyclohexane-1-carboxamide

Systemtic Name: N-[3-[butyl(phenyl)amino]propyl]-4-(phenylsulfonylaminomethyl)cyclohexane-1-carboxamide Openeye Name: 4-(benzenesulfonamidomethyl)-N-[3-(N-butylanilino)propyl]cyclohexanecarboxamide CAS Name: 4-(benzenesulfonamidomethyl)-N-[3-(N-butylanilino)propyl]-1-cyclohexanecarboxamide IUPAC Name: 4-(benzenesulfonamidomethyl)-N-[3-(N-butylanilino)propyl]cyclohexane-1-carboxamide Traditional Name: 4-(benzenesulfonamidomethyl)-N-[3-(N-butylanilino)propyl]cyclohexanecarboxamide Formula: C27H39N3O3S MolecularWeight: 485.68186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCNC(=O)C1CCC(CC1)CNS(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCN(CCCNC(=O)C1CCC(CC1)CNS(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H39N3O3S/c1-2-3-20-30(25-11-6-4-7-12-25)21-10-19-28-27(31)24-17-15-23(16-18-24)22-29-34(32,33)26-13-8-5-9-14-26/h4-9,11-14,23-24,29H,2-3,10,15-22H2,1H3,(H,28,31)