methyl 4-(4-chlorophenyl)carbonyl-1-oxidanylidene-pyrido[2,1-b][1,3]benzothiazole-3-carboxylate

Systemtic Name: methyl 4-(4-chlorophenyl)carbonyl-1-oxidanylidene-pyrido[2,1-b][1,3]benzothiazole-3-carboxylate Openeye Name: methyl 4-(4-chlorobenzoyl)-1-oxo-pyrido[2,1-b][1,3]benzothiazole-3-carboxylate CAS Name: 4-[(4-chlorophenyl)-oxomethyl]-1-oxo-3-pyrido[2,1-b][1,3]benzothiazolecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-chlorobenzoyl)-1-oxopyrido[2,1-b][1,3]benzothiazole-3-carboxylate Traditional Name: 4-(4-chlorobenzoyl)-1-keto-pyrido[2,1-b][1,3]benzothiazole-3-carboxylic acid methyl ester Formula: C20H12ClNO4S MolecularWeight: 397.83158

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=O)N2C3=CC=CC=C3SC2=C1C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC(=O)C1=CC(=O)N2C3=CC=CC=C3SC2=C1C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H12ClNO4S/c1-26-20(25)13-10-16(23)22-14-4-2-3-5-15(14)27-19(22)17(13)18(24)11-6-8-12(21)9-7-11/h2-10H,1H3