[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]-(2-methylsulfanylpyridin-3-yl)methanone

Systemtic Name: [4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]-(2-methylsulfanylpyridin-3-yl)methanone Openeye Name: [4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]-(2-methylsulfanyl-3-pyridyl)methanone CAS Name: [4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]-[2-(methylthio)-3-pyridinyl]methanone IUPAC Name: [4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]-(2-methylsulfanylpyridin-3-yl)methanone Traditional Name: [4-(3-fluoro-4-methoxy-benzyl)piperazino]-[2-(methylthio)-3-pyridyl]methanone Formula: C19H22FN3O2S MolecularWeight: 375.460283

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)C3=C(N=CC=C3)SC)F

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)C3=C(N=CC=C3)SC)F

InChI

InChI=1S/C19H22FN3O2S/c1-25-17-6-5-14(12-16(17)20)13-22-8-10-23(11-9-22)19(24)15-4-3-7-21-18(15)26-2/h3-7,12H,8-11,13H2,1-2H3