1-[2-[[5-[4-(4-cyanophenyl)piperidin-1-yl]carbonyl-2-methyl-phenyl]amino]-2-oxidanylidene-ethyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-[[5-[4-(4-cyanophenyl)piperidin-1-yl]carbonyl-2-methyl-phenyl]amino]-2-oxidanylidene-ethyl]piperidine-4-carboxamide Openeye Name: 1-[2-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2-methyl-anilino]-2-oxo-ethyl]piperidine-4-carboxamide CAS Name: 1-[2-[5-[[4-(4-cyanophenyl)-1-piperidinyl]-oxomethyl]-2-methylanilino]-2-oxoethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2-methylanilino]-2-oxoethyl]piperidine-4-carboxamide Traditional Name: 1-[2-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2-methyl-anilino]-2-keto-ethyl]isonipecotamide Formula: C28H33N5O3 MolecularWeight: 487.59332

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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)NC(=O)CN4CCC(CC4)C(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C3=CC=C(C=C3)C#N)NC(=O)CN4CCC(CC4)C(=O)N

InChI

InChI=1S/C28H33N5O3/c1-19-2-5-24(16-25(19)31-26(34)18-32-12-8-23(9-13-32)27(30)35)28(36)33-14-10-22(11-15-33)21-6-3-20(17-29)4-7-21/h2-7,16,22-23H,8-15,18H2,1H3,(H2,30,35)(H,31,34)