(5-chloranyl-2-propylsulfanyl-pyrimidin-4-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone

Systemtic Name: (5-chloranyl-2-propylsulfanyl-pyrimidin-4-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone Openeye Name: (5-chloro-2-propylsulfanyl-pyrimidin-4-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone CAS Name: [5-chloro-2-(propylthio)-4-pyrimidinyl]-[4-(4-methoxyphenyl)-1-piperazinyl]methanone IUPAC Name: (5-chloro-2-propylsulfanylpyrimidin-4-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone Traditional Name: [5-chloro-2-(propylthio)pyrimidin-4-yl]-[4-(4-methoxyphenyl)piperazino]methanone Formula: C19H23ClN4O2S MolecularWeight: 406.92952

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC=C(C(=N1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)OC)Cl

Isomeric SMILES

CCCSC1=NC=C(C(=N1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)OC)Cl

InChI

InChI=1S/C19H23ClN4O2S/c1-3-12-27-19-21-13-16(20)17(22-19)18(25)24-10-8-23(9-11-24)14-4-6-15(26-2)7-5-14/h4-7,13H,3,8-12H2,1-2H3