4-chloranyl-5-[4-[3-(4-methylphenyl)sulfanylpropanoyl]piperazin-1-yl]-2-phenyl-pyridazin-3-one

Systemtic Name: 4-chloranyl-5-[4-[3-(4-methylphenyl)sulfanylpropanoyl]piperazin-1-yl]-2-phenyl-pyridazin-3-one Openeye Name: 4-chloro-2-phenyl-5-[4-[3-(p-tolylsulfanyl)propanoyl]piperazin-1-yl]pyridazin-3-one CAS Name: 4-chloro-5-[4-[3-[(4-methylphenyl)thio]-1-oxopropyl]-1-piperazinyl]-2-phenyl-3-pyridazinone IUPAC Name: 4-chloro-5-[4-[3-(4-methylphenyl)sulfanylpropanoyl]piperazin-1-yl]-2-phenylpyridazin-3-one Traditional Name: 4-chloro-2-phenyl-5-[4-[3-(p-tolylthio)propanoyl]piperazino]pyridazin-3-one Formula: C24H25ClN4O2S MolecularWeight: 468.9989

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H25ClN4O2S/c1-18-7-9-20(10-8-18)32-16-11-22(30)28-14-12-27(13-15-28)21-17-26-29(24(31)23(21)25)19-5-3-2-4-6-19/h2-10,17H,11-16H2,1H3