ethyl 2-[(2-cyano-3-pyridin-3-yl-prop-2-enoyl)amino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(2-cyano-3-pyridin-3-yl-prop-2-enoyl)amino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-cyano-3-(3-pyridyl)prop-2-enoyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[2-cyano-1-oxo-3-(3-pyridinyl)prop-2-enyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-cyano-3-pyridin-3-ylprop-2-enoyl)amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[2-cyano-3-(3-pyridyl)acryloyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C(=CC2=CN=CC=C2)C#N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C(=CC2=CN=CC=C2)C#N

InChI

InChI=1S/C18H17N3O3S/c1-4-24-18(23)15-11(2)12(3)25-17(15)21-16(22)14(9-19)8-13-6-5-7-20-10-13/h5-8,10H,4H2,1-3H3,(H,21,22)