(E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-N-(2-methyl-1-thiophen-2-yl-propyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-N-(2-methyl-1-thiophen-2-yl-propyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-N-[2-methyl-1-(2-thienyl)propyl]prop-2-enamide CAS Name: (E)-2-cyano-3-(2,5-dimethyl-1-propyl-3-pyrrolyl)-N-(2-methyl-1-thiophen-2-ylpropyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-(2,5-dimethyl-1-propylpyrrol-3-yl)-N-(2-methyl-1-thiophen-2-ylpropyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-N-[2-methyl-1-(2-thienyl)propyl]acrylamide Formula: C21H27N3OS MolecularWeight: 369.52358

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C=C(C#N)C(=O)NC(C2=CC=CS2)C(C)C)C

Isomeric SMILES

CCCN1C(=CC(=C1C)/C=C(\C#N)/C(=O)NC(C2=CC=CS2)C(C)C)C

InChI

InChI=1S/C21H27N3OS/c1-6-9-24-15(4)11-17(16(24)5)12-18(13-22)21(25)23-20(14(2)3)19-8-7-10-26-19/h7-8,10-12,14,20H,6,9H2,1-5H3,(H,23,25)/b18-12+