methyl 2-(1,3-benzothiazol-2-ylcarbonylamino)-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate

Systemtic Name: methyl 2-(1,3-benzothiazol-2-ylcarbonylamino)-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Openeye Name: methyl 2-(1,3-benzothiazole-2-carbonylamino)-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate CAS Name: 2-[[1,3-benzothiazol-2-yl(oxo)methyl]amino]-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid methyl ester IUPAC Name: methyl 2-(1,3-benzothiazole-2-carbonylamino)-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Traditional Name: 2-(1,3-benzothiazole-2-carbonylamino)-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid methyl ester Formula: C18H14N4O3S2 MolecularWeight: 398.45876

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=NC4=CC=CC=C4S3

Isomeric SMILES

COC(=O)N1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H14N4O3S2/c1-25-18(24)22-7-6-10-11(8-19)16(27-14(10)9-22)21-15(23)17-20-12-4-2-3-5-13(12)26-17/h2-5H,6-7,9H2,1H3,(H,21,23)