2-(1,3-benzothiazol-2-yl)-4-chloranyl-5-[(3,5-dimethoxyphenyl)amino]pyridazin-3-one

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-4-chloranyl-5-[(3,5-dimethoxyphenyl)amino]pyridazin-3-one Openeye Name: 2-(1,3-benzothiazol-2-yl)-4-chloro-5-(3,5-dimethoxyanilino)pyridazin-3-one CAS Name: 2-(1,3-benzothiazol-2-yl)-4-chloro-5-(3,5-dimethoxyanilino)-3-pyridazinone IUPAC Name: 2-(1,3-benzothiazol-2-yl)-4-chloro-5-(3,5-dimethoxyanilino)pyridazin-3-one Traditional Name: 2-(1,3-benzothiazol-2-yl)-4-chloro-5-(3,5-dimethoxyanilino)pyridazin-3-one Formula: C19H15ClN4O3S MolecularWeight: 414.8654

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC2=C(C(=O)N(N=C2)C3=NC4=CC=CC=C4S3)Cl)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC2=C(C(=O)N(N=C2)C3=NC4=CC=CC=C4S3)Cl)OC

InChI

InChI=1S/C19H15ClN4O3S/c1-26-12-7-11(8-13(9-12)27-2)22-15-10-21-24(18(25)17(15)20)19-23-14-5-3-4-6-16(14)28-19/h3-10,22H,1-2H3