(4-oxidanylidene-4-thiophen-2-yl-butyl) 3-(5-cyano-2,4-dimethyl-6-oxidanylidene-1H-pyridin-3-yl)propanoate

Systemtic Name: (4-oxidanylidene-4-thiophen-2-yl-butyl) 3-(5-cyano-2,4-dimethyl-6-oxidanylidene-1H-pyridin-3-yl)propanoate Openeye Name: [4-oxo-4-(2-thienyl)butyl] 3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)propanoate CAS Name: 3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)propanoic acid (4-oxo-4-thiophen-2-ylbutyl) ester IUPAC Name: (4-oxo-4-thiophen-2-ylbutyl) 3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)propanoate Traditional Name: 3-(5-cyano-6-keto-2,4-dimethyl-1H-pyridin-3-yl)propionic acid [4-keto-4-(2-thienyl)butyl] ester Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=C1CCC(=O)OCCCC(=O)C2=CC=CS2)C)C#N

Isomeric SMILES

CC1=C(C(=O)NC(=C1CCC(=O)OCCCC(=O)C2=CC=CS2)C)C#N

InChI

InChI=1S/C19H20N2O4S/c1-12-14(13(2)21-19(24)15(12)11-20)7-8-18(23)25-9-3-5-16(22)17-6-4-10-26-17/h4,6,10H,3,5,7-9H2,1-2H3,(H,21,24)