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

Systemtic Name: [4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-(4-ethyl-2-methylsulfanyl-pyrimidin-5-yl)methanone Openeye Name: [4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-(4-ethyl-2-methylsulfanyl-pyrimidin-5-yl)methanone CAS Name: [4-(5-chloro-2-methylphenyl)-1-piperazinyl]-[4-ethyl-2-(methylthio)-5-pyrimidinyl]methanone IUPAC Name: [4-(5-chloro-2-methylphenyl)piperazin-1-yl]-(4-ethyl-2-methylsulfanylpyrimidin-5-yl)methanone Traditional Name: [4-(5-chloro-2-methyl-phenyl)piperazino]-[4-ethyl-2-(methylthio)pyrimidin-5-yl]methanone Formula: C19H23ClN4OS MolecularWeight: 390.93012

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NC=C1C(=O)N2CCN(CC2)C3=C(C=CC(=C3)Cl)C)SC

Isomeric SMILES

CCC1=NC(=NC=C1C(=O)N2CCN(CC2)C3=C(C=CC(=C3)Cl)C)SC

InChI

InChI=1S/C19H23ClN4OS/c1-4-16-15(12-21-19(22-16)26-3)18(25)24-9-7-23(8-10-24)17-11-14(20)6-5-13(17)2/h5-6,11-12H,4,7-10H2,1-3H3