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

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-4-chloranyl-5-[4-(2,5-dimethylphenyl)piperazin-1-yl]pyridazin-3-one Openeye Name: 2-(1,3-benzothiazol-2-yl)-4-chloro-5-[4-(2,5-dimethylphenyl)piperazin-1-yl]pyridazin-3-one CAS Name: 2-(1,3-benzothiazol-2-yl)-4-chloro-5-[4-(2,5-dimethylphenyl)-1-piperazinyl]-3-pyridazinone IUPAC Name: 2-(1,3-benzothiazol-2-yl)-4-chloro-5-[4-(2,5-dimethylphenyl)piperazin-1-yl]pyridazin-3-one Traditional Name: 2-(1,3-benzothiazol-2-yl)-4-chloro-5-[4-(2,5-dimethylphenyl)piperazino]pyridazin-3-one Formula: C23H22ClN5OS MolecularWeight: 451.97168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C3=C(C(=O)N(N=C3)C4=NC5=CC=CC=C5S4)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C3=C(C(=O)N(N=C3)C4=NC5=CC=CC=C5S4)Cl

InChI

InChI=1S/C23H22ClN5OS/c1-15-7-8-16(2)18(13-15)27-9-11-28(12-10-27)19-14-25-29(22(30)21(19)24)23-26-17-5-3-4-6-20(17)31-23/h3-8,13-14H,9-12H2,1-2H3