(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: (5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]methanone Openeye Name: (5-chloro-2-methylsulfanyl-pyrimidin-4-yl)-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]methanone CAS Name: [5-chloro-2-(methylthio)-4-pyrimidinyl]-[4-[(2,5-dimethoxyphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: (5-chloro-2-methylsulfanylpyrimidin-4-yl)-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]methanone Traditional Name: [5-chloro-2-(methylthio)pyrimidin-4-yl]-[4-(2,5-dimethoxybenzyl)piperazino]methanone Formula: C19H23ClN4O3S MolecularWeight: 422.92892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CN2CCN(CC2)C(=O)C3=NC(=NC=C3Cl)SC

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CN2CCN(CC2)C(=O)C3=NC(=NC=C3Cl)SC

InChI

InChI=1S/C19H23ClN4O3S/c1-26-14-4-5-16(27-2)13(10-14)12-23-6-8-24(9-7-23)18(25)17-15(20)11-21-19(22-17)28-3/h4-5,10-11H,6-9,12H2,1-3H3