3-[1-[4-(cyanomethyl)phenyl]-5-(2,4-dimethylphenyl)pyrrol-2-yl]-N-piperidin-4-yl-propanamide

Systemtic Name: 3-[1-[4-(cyanomethyl)phenyl]-5-(2,4-dimethylphenyl)pyrrol-2-yl]-N-piperidin-4-yl-propanamide Openeye Name: 3-[1-[4-(cyanomethyl)phenyl]-5-(2,4-dimethylphenyl)pyrrol-2-yl]-N-(4-piperidyl)propanamide CAS Name: 3-[1-[4-(cyanomethyl)phenyl]-5-(2,4-dimethylphenyl)-2-pyrrolyl]-N-(4-piperidinyl)propanamide IUPAC Name: 3-[1-[4-(cyanomethyl)phenyl]-5-(2,4-dimethylphenyl)pyrrol-2-yl]-N-piperidin-4-ylpropanamide Traditional Name: 3-[1-[4-(cyanomethyl)phenyl]-5-(2,4-dimethylphenyl)pyrrol-2-yl]-N-(4-piperidyl)propionamide Formula: C28H32N4O MolecularWeight: 440.57988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=CC=C(N2C3=CC=C(C=C3)CC#N)CCC(=O)NC4CCNCC4)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=CC=C(N2C3=CC=C(C=C3)CC#N)CCC(=O)NC4CCNCC4)C

InChI

InChI=1S/C28H32N4O/c1-20-3-10-26(21(2)19-20)27-11-8-25(9-12-28(33)31-23-14-17-30-18-15-23)32(27)24-6-4-22(5-7-24)13-16-29/h3-8,10-11,19,23,30H,9,12-15,17-18H2,1-2H3,(H,31,33)