[2-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]amino]-2-oxidanylidene-ethyl] 6-oxidanylidene-1H-pyridine-3-carboxylate

Systemtic Name: [2-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]amino]-2-oxidanylidene-ethyl] 6-oxidanylidene-1H-pyridine-3-carboxylate Openeye Name: [2-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-2-oxo-ethyl] 6-oxo-1H-pyridine-3-carboxylate CAS Name: 6-oxo-1H-pyridine-3-carboxylic acid [2-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-2-oxoethyl] 6-oxo-1H-pyridine-3-carboxylate Traditional Name: 6-keto-1H-pyridine-3-carboxylic acid [2-keto-2-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]ethyl] ester Formula: C22H17N3O4S MolecularWeight: 419.45308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)COC(=O)C4=CNC(=O)C=C4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)COC(=O)C4=CNC(=O)C=C4

InChI

InChI=1S/C22H17N3O4S/c1-13-2-8-17-18(10-13)30-21(25-17)14-3-6-16(7-4-14)24-20(27)12-29-22(28)15-5-9-19(26)23-11-15/h2-11H,12H2,1H3,(H,23,26)(H,24,27)