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

Systemtic Name: 2-(2-chlorophenyl)-7-[[4-(4-ethoxyphenyl)carbonylpiperazin-1-yl]methyl]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one Openeye Name: 2-(2-chlorophenyl)-7-[[4-(4-ethoxybenzoyl)piperazin-1-yl]methyl]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one CAS Name: 2-(2-chlorophenyl)-7-[[4-[(4-ethoxyphenyl)-oxomethyl]-1-piperazinyl]methyl]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one IUPAC Name: 2-(2-chlorophenyl)-7-[[4-(4-ethoxybenzoyl)piperazin-1-yl]methyl]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one Traditional Name: 2-(2-chlorophenyl)-7-[[4-(4-ethoxybenzoyl)piperazino]methyl]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one Formula: C25H24ClN5O3S MolecularWeight: 510.00776

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=CC(=O)N4C(=N3)SC(=N4)C5=CC=CC=C5Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=CC(=O)N4C(=N3)SC(=N4)C5=CC=CC=C5Cl

InChI

InChI=1S/C25H24ClN5O3S/c1-2-34-19-9-7-17(8-10-19)24(33)30-13-11-29(12-14-30)16-18-15-22(32)31-25(27-18)35-23(28-31)20-5-3-4-6-21(20)26/h3-10,15H,2,11-14,16H2,1H3