(E)-2-cyano-3-(5-cyano-1,2-dimethyl-pyrrol-3-yl)-N-methyl-N-[(4-piperidin-1-ylphenyl)methyl]prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(5-cyano-1,2-dimethyl-pyrrol-3-yl)-N-methyl-N-[(4-piperidin-1-ylphenyl)methyl]prop-2-enamide Openeye Name: (E)-2-cyano-3-(5-cyano-1,2-dimethyl-pyrrol-3-yl)-N-methyl-N-[[4-(1-piperidyl)phenyl]methyl]prop-2-enamide CAS Name: (E)-2-cyano-3-(5-cyano-1,2-dimethyl-3-pyrrolyl)-N-methyl-N-[[4-(1-piperidinyl)phenyl]methyl]-2-propenamide IUPAC Name: (E)-2-cyano-3-(5-cyano-1,2-dimethylpyrrol-3-yl)-N-methyl-N-[(4-piperidin-1-ylphenyl)methyl]prop-2-enamide Traditional Name: (E)-2-cyano-3-(5-cyano-1,2-dimethyl-pyrrol-3-yl)-N-methyl-N-(4-piperidinobenzyl)acrylamide Formula: C24H27N5O MolecularWeight: 401.50408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C)C#N)C=C(C#N)C(=O)N(C)CC2=CC=C(C=C2)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(N1C)C#N)/C=C(\C#N)/C(=O)N(C)CC2=CC=C(C=C2)N3CCCCC3

InChI

InChI=1S/C24H27N5O/c1-18-20(14-23(16-26)28(18)3)13-21(15-25)24(30)27(2)17-19-7-9-22(10-8-19)29-11-5-4-6-12-29/h7-10,13-14H,4-6,11-12,17H2,1-3H3/b21-13+