N-[5-[4-(4-cyanophenyl)piperidin-1-yl]carbonyl-2-methyl-phenyl]-3-(propan-2-ylamino)propane-1-sulfonamide

Systemtic Name: N-[5-[4-(4-cyanophenyl)piperidin-1-yl]carbonyl-2-methyl-phenyl]-3-(propan-2-ylamino)propane-1-sulfonamide Openeye Name: N-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2-methyl-phenyl]-3-(isopropylamino)propane-1-sulfonamide CAS Name: N-[5-[[4-(4-cyanophenyl)-1-piperidinyl]-oxomethyl]-2-methylphenyl]-3-(propan-2-ylamino)-1-propanesulfonamide IUPAC Name: N-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2-methylphenyl]-3-(propan-2-ylamino)propane-1-sulfonamide Traditional Name: N-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2-methyl-phenyl]-3-(isopropylamino)propane-1-sulfonamide Formula: C26H34N4O3S MolecularWeight: 482.63816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C3=CC=C(C=C3)C#N)NS(=O)(=O)CCCNC(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C3=CC=C(C=C3)C#N)NS(=O)(=O)CCCNC(C)C

InChI

InChI=1S/C26H34N4O3S/c1-19(2)28-13-4-16-34(32,33)29-25-17-24(8-5-20(25)3)26(31)30-14-11-23(12-15-30)22-9-6-21(18-27)7-10-22/h5-10,17,19,23,28-29H,4,11-16H2,1-3H3