propan-2-yl 4-cyano-3-methyl-5-(pyridin-4-ylcarbonylamino)thiophene-2-carboxylate

Systemtic Name: propan-2-yl 4-cyano-3-methyl-5-(pyridin-4-ylcarbonylamino)thiophene-2-carboxylate Openeye Name: isopropyl 4-cyano-3-methyl-5-(pyridine-4-carbonylamino)thiophene-2-carboxylate CAS Name: 4-cyano-3-methyl-5-[[oxo(pyridin-4-yl)methyl]amino]-2-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-cyano-3-methyl-5-(pyridine-4-carbonylamino)thiophene-2-carboxylate Traditional Name: 4-cyano-5-isonicotinamido-3-methyl-thiophene-2-carboxylic acid isopropyl ester Formula: C16H15N3O3S MolecularWeight: 329.3736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C2=CC=NC=C2)C(=O)OC(C)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C2=CC=NC=C2)C(=O)OC(C)C

InChI

InChI=1S/C16H15N3O3S/c1-9(2)22-16(21)13-10(3)12(8-17)15(23-13)19-14(20)11-4-6-18-7-5-11/h4-7,9H,1-3H3,(H,19,20)