methyl 2-[[(E)-2-cyano-3-pyridin-3-yl-prop-2-enoyl]amino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[[(E)-2-cyano-3-pyridin-3-yl-prop-2-enoyl]amino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[(E)-2-cyano-3-(3-pyridyl)prop-2-enoyl]amino]-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[(E)-2-cyano-1-oxo-3-(3-pyridinyl)prop-2-enyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(E)-2-cyano-3-pyridin-3-ylprop-2-enoyl]amino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[[(E)-2-cyano-3-(3-pyridyl)acryloyl]amino]-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C16H13N3O3S MolecularWeight: 327.35772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=O)C(=CC2=CN=CC=C2)C#N)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=O)/C(=C/C2=CN=CC=C2)/C#N)C(=O)OC

InChI

InChI=1S/C16H13N3O3S/c1-10-6-13(16(21)22-2)15(23-10)19-14(20)12(8-17)7-11-4-3-5-18-9-11/h3-7,9H,1-2H3,(H,19,20)/b12-7+