methyl 5-methylsulfanyl-4-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]thiophene-2-carboxylate

Systemtic Name: methyl 5-methylsulfanyl-4-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]thiophene-2-carboxylate Openeye Name: methyl 5-methylsulfanyl-4-[4-(4-nitrophenyl)thiazol-2-yl]thiophene-2-carboxylate CAS Name: 5-(methylthio)-4-[4-(4-nitrophenyl)-2-thiazolyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-methylsulfanyl-4-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]thiophene-2-carboxylate Traditional Name: 5-(methylthio)-4-[4-(4-nitrophenyl)thiazol-2-yl]thiophene-2-carboxylic acid methyl ester Formula: C16H12N2O4S3 MolecularWeight: 392.47248

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(S1)SC)C2=NC(=CS2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(S1)SC)C2=NC(=CS2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H12N2O4S3/c1-22-15(19)13-7-11(16(23-2)25-13)14-17-12(8-24-14)9-3-5-10(6-4-9)18(20)21/h3-8H,1-2H3