7-[[4-(4-methylphenyl)carbonylpiperazin-1-yl]methyl]-2-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one

Systemtic Name: 7-[[4-(4-methylphenyl)carbonylpiperazin-1-yl]methyl]-2-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one Openeye Name: 7-[[4-(4-methylbenzoyl)piperazin-1-yl]methyl]-2-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one CAS Name: 7-[[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]methyl]-2-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one IUPAC Name: 7-[[4-(4-methylbenzoyl)piperazin-1-yl]methyl]-2-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one Traditional Name: 2-phenyl-7-[(4-p-toluoylpiperazino)methyl]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one Formula: C24H23N5O2S MolecularWeight: 445.53672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=CC(=O)N4C(=N3)SC(=N4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=CC(=O)N4C(=N3)SC(=N4)C5=CC=CC=C5

InChI

InChI=1S/C24H23N5O2S/c1-17-7-9-19(10-8-17)23(31)28-13-11-27(12-14-28)16-20-15-21(30)29-24(25-20)32-22(26-29)18-5-3-2-4-6-18/h2-10,15H,11-14,16H2,1H3