2,6-dimethyl-5-[3-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-propyl]-1H-pyrimidin-4-one

Systemtic Name: 2,6-dimethyl-5-[3-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-propyl]-1H-pyrimidin-4-one Openeye Name: 2,6-dimethyl-5-[3-oxo-3-[4-(p-tolylsulfonyl)piperazin-1-yl]propyl]-1H-pyrimidin-4-one CAS Name: 2,6-dimethyl-5-[3-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-3-oxopropyl]-1H-pyrimidin-4-one IUPAC Name: 2,6-dimethyl-5-[3-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-oxopropyl]-1H-pyrimidin-4-one Traditional Name: 5-[3-keto-3-(4-tosylpiperazino)propyl]-2,6-dimethyl-1H-pyrimidin-4-one Formula: C20H26N4O4S MolecularWeight: 418.50984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC3=C(NC(=NC3=O)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC3=C(NC(=NC3=O)C)C

InChI

InChI=1S/C20H26N4O4S/c1-14-4-6-17(7-5-14)29(27,28)24-12-10-23(11-13-24)19(25)9-8-18-15(2)21-16(3)22-20(18)26/h4-7H,8-13H2,1-3H3,(H,21,22,26)