2-(4-methylphenyl)-6-[4-[2-(4-methylpyrimidin-2-yl)sulfanylethanoyl]piperazin-1-yl]pyridazin-3-one

Systemtic Name: 2-(4-methylphenyl)-6-[4-[2-(4-methylpyrimidin-2-yl)sulfanylethanoyl]piperazin-1-yl]pyridazin-3-one Openeye Name: 6-[4-[2-(4-methylpyrimidin-2-yl)sulfanylacetyl]piperazin-1-yl]-2-(p-tolyl)pyridazin-3-one CAS Name: 2-(4-methylphenyl)-6-[4-[2-[(4-methyl-2-pyrimidinyl)thio]-1-oxoethyl]-1-piperazinyl]-3-pyridazinone IUPAC Name: 2-(4-methylphenyl)-6-[4-[2-(4-methylpyrimidin-2-yl)sulfanylacetyl]piperazin-1-yl]pyridazin-3-one Traditional Name: 6-[4-[2-[(4-methylpyrimidin-2-yl)thio]acetyl]piperazino]-2-(p-tolyl)pyridazin-3-one Formula: C22H24N6O2S MolecularWeight: 436.52996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C=CC(=N2)N3CCN(CC3)C(=O)CSC4=NC=CC(=N4)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C=CC(=N2)N3CCN(CC3)C(=O)CSC4=NC=CC(=N4)C

InChI

InChI=1S/C22H24N6O2S/c1-16-3-5-18(6-4-16)28-20(29)8-7-19(25-28)26-11-13-27(14-12-26)21(30)15-31-22-23-10-9-17(2)24-22/h3-10H,11-15H2,1-2H3