[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-(2-methylsulfanylpyridin-3-yl)methanone

Systemtic Name: [4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-(2-methylsulfanylpyridin-3-yl)methanone Openeye Name: [4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-(2-methylsulfanyl-3-pyridyl)methanone CAS Name: [4-(5-chloro-2-methylphenyl)-1-piperazinyl]-[2-(methylthio)-3-pyridinyl]methanone IUPAC Name: [4-(5-chloro-2-methylphenyl)piperazin-1-yl]-(2-methylsulfanylpyridin-3-yl)methanone Traditional Name: [4-(5-chloro-2-methyl-phenyl)piperazino]-[2-(methylthio)-3-pyridyl]methanone Formula: C18H20ClN3OS MolecularWeight: 361.8889

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3=C(N=CC=C3)SC

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3=C(N=CC=C3)SC

InChI

InChI=1S/C18H20ClN3OS/c1-13-5-6-14(19)12-16(13)21-8-10-22(11-9-21)18(23)15-4-3-7-20-17(15)24-2/h3-7,12H,8-11H2,1-2H3