(E)-N-butan-2-yl-2-cyano-3-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enamide

Systemtic Name: (E)-N-butan-2-yl-2-cyano-3-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enamide Openeye Name: (E)-2-cyano-3-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]-N-sec-butyl-prop-2-enamide CAS Name: (E)-N-butan-2-yl-2-cyano-3-[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]-2-propenamide IUPAC Name: (E)-N-butan-2-yl-2-cyano-3-[1-(4-methoxyphenyl)-2,5-dimethylpyrrol-3-yl]prop-2-enamide Traditional Name: (E)-2-cyano-3-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]-N-sec-butyl-acrylamide Formula: C21H25N3O2 MolecularWeight: 351.4421

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C(=CC1=C(N(C(=C1)C)C2=CC=C(C=C2)OC)C)C#N

Isomeric SMILES

CCC(C)NC(=O)/C(=C/C1=C(N(C(=C1)C)C2=CC=C(C=C2)OC)C)/C#N

InChI

InChI=1S/C21H25N3O2/c1-6-14(2)23-21(25)18(13-22)12-17-11-15(3)24(16(17)4)19-7-9-20(26-5)10-8-19/h7-12,14H,6H2,1-5H3,(H,23,25)/b18-12+