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

Systemtic Name: N-[5-[4-(4-cyanophenyl)piperidin-1-yl]carbonyl-2-methyl-phenyl]-3-morpholin-4-yl-propane-1-sulfonamide Openeye Name: N-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2-methyl-phenyl]-3-morpholino-propane-1-sulfonamide CAS Name: N-[5-[[4-(4-cyanophenyl)-1-piperidinyl]-oxomethyl]-2-methylphenyl]-3-(4-morpholinyl)-1-propanesulfonamide IUPAC Name: N-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2-methylphenyl]-3-morpholin-4-ylpropane-1-sulfonamide Traditional Name: N-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2-methyl-phenyl]-3-morpholino-propane-1-sulfonamide Formula: C27H34N4O4S MolecularWeight: 510.64826

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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)CCCN4CCOCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C3=CC=C(C=C3)C#N)NS(=O)(=O)CCCN4CCOCC4

InChI

InChI=1S/C27H34N4O4S/c1-21-3-6-25(19-26(21)29-36(33,34)18-2-11-30-14-16-35-17-15-30)27(32)31-12-9-24(10-13-31)23-7-4-22(20-28)5-8-23/h3-8,19,24,29H,2,9-18H2,1H3