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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=C(C=C2)C)C3=C(C(=O)N(N=C3)C4=NC5=CC=CC=C5S4)Cl

Isomeric SMILES

CC1CN(CCN1C2=CC=C(C=C2)C)C3=C(C(=O)N(N=C3)C4=NC5=CC=CC=C5S4)Cl

InChI

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