1,3-benzothiazol-2-ylmethyl 1-(3-methylphenyl)-6-oxidanylidene-4,5-dihydropyridazine-3-carboxylate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 1-(3-methylphenyl)-6-oxidanylidene-4,5-dihydropyridazine-3-carboxylate Openeye Name: 1,3-benzothiazol-2-ylmethyl 1-(m-tolyl)-6-oxo-4,5-dihydropyridazine-3-carboxylate CAS Name: 1-(3-methylphenyl)-6-oxo-4,5-dihydropyridazine-3-carboxylic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 1-(3-methylphenyl)-6-oxo-4,5-dihydropyridazine-3-carboxylate Traditional Name: 6-keto-1-(m-tolyl)-4,5-dihydropyridazine-3-carboxylic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)CCC(=N2)C(=O)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)CCC(=N2)C(=O)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H17N3O3S/c1-13-5-4-6-14(11-13)23-19(24)10-9-16(22-23)20(25)26-12-18-21-15-7-2-3-8-17(15)27-18/h2-8,11H,9-10,12H2,1H3