ethyl 2-[[1-(3-chlorophenyl)-4-oxidanylidene-pyridazin-3-yl]carbonylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 2-[[1-(3-chlorophenyl)-4-oxidanylidene-pyridazin-3-yl]carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-[[1-(3-chlorophenyl)-4-oxo-pyridazine-3-carbonyl]amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[[1-(3-chlorophenyl)-4-oxo-3-pyridazinyl]-oxomethyl]amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[1-(3-chlorophenyl)-4-oxopyridazine-3-carbonyl]amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[[1-(3-chlorophenyl)-4-keto-pyridazine-3-carbonyl]amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C21H15ClN4O4S MolecularWeight: 454.8862

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NN(C=CC3=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NN(C=CC3=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H15ClN4O4S/c1-2-30-20(29)12-6-7-15-17(10-12)31-21(23-15)24-19(28)18-16(27)8-9-26(25-18)14-5-3-4-13(22)11-14/h3-11H,2H2,1H3,(H,23,24,28)