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

Systemtic Name: (5-chloranyl-2-propan-2-ylsulfanyl-pyrimidin-4-yl)-[4-(2-methoxyphenyl)piperazin-1-yl]methanone Openeye Name: (5-chloro-2-isopropylsulfanyl-pyrimidin-4-yl)-[4-(2-methoxyphenyl)piperazin-1-yl]methanone CAS Name: [5-chloro-2-(propan-2-ylthio)-4-pyrimidinyl]-[4-(2-methoxyphenyl)-1-piperazinyl]methanone IUPAC Name: (5-chloro-2-propan-2-ylsulfanylpyrimidin-4-yl)-[4-(2-methoxyphenyl)piperazin-1-yl]methanone Traditional Name: [5-chloro-2-(isopropylthio)pyrimidin-4-yl]-[4-(2-methoxyphenyl)piperazino]methanone Formula: C19H23ClN4O2S MolecularWeight: 406.92952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NC=C(C(=N1)C(=O)N2CCN(CC2)C3=CC=CC=C3OC)Cl

Isomeric SMILES

CC(C)SC1=NC=C(C(=N1)C(=O)N2CCN(CC2)C3=CC=CC=C3OC)Cl

InChI

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