(5-chloranyl-2-propylsulfanyl-pyrimidin-4-yl)-[4-(3-chlorophenyl)piperazin-1-yl]methanone

Systemtic Name: (5-chloranyl-2-propylsulfanyl-pyrimidin-4-yl)-[4-(3-chlorophenyl)piperazin-1-yl]methanone Openeye Name: [4-(3-chlorophenyl)piperazin-1-yl]-(5-chloro-2-propylsulfanyl-pyrimidin-4-yl)methanone CAS Name: [4-(3-chlorophenyl)-1-piperazinyl]-[5-chloro-2-(propylthio)-4-pyrimidinyl]methanone IUPAC Name: [4-(3-chlorophenyl)piperazin-1-yl]-(5-chloro-2-propylsulfanylpyrimidin-4-yl)methanone Traditional Name: [4-(3-chlorophenyl)piperazino]-[5-chloro-2-(propylthio)pyrimidin-4-yl]methanone Formula: C18H20Cl2N4OS MolecularWeight: 411.3486

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20Cl2N4OS/c1-2-10-26-18-21-12-15(20)16(22-18)17(25)24-8-6-23(7-9-24)14-5-3-4-13(19)11-14/h3-5,11-12H,2,6-10H2,1H3