3-[5-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]sulfonylthiophen-2-yl]-1H-pyridazin-6-one

Systemtic Name: 3-[5-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]sulfonylthiophen-2-yl]-1H-pyridazin-6-one Openeye Name: 3-[5-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]sulfonyl-2-thienyl]-1H-pyridazin-6-one CAS Name: 3-[5-[[4-(5-chloro-2-methylphenyl)-1-piperazinyl]sulfonyl]-2-thiophenyl]-1H-pyridazin-6-one IUPAC Name: 3-[5-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]sulfonylthiophen-2-yl]-1H-pyridazin-6-one Traditional Name: 3-[5-[4-(5-chloro-2-methyl-phenyl)piperazino]sulfonyl-2-thienyl]-1H-pyridazin-6-one Formula: C19H19ClN4O3S2 MolecularWeight: 450.96216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)C4=NNC(=O)C=C4

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)C4=NNC(=O)C=C4

InChI

InChI=1S/C19H19ClN4O3S2/c1-13-2-3-14(20)12-16(13)23-8-10-24(11-9-23)29(26,27)19-7-5-17(28-19)15-4-6-18(25)22-21-15/h2-7,12H,8-11H2,1H3,(H,22,25)