[1-[(1-methylpyrazol-4-yl)methyl]piperidin-3-yl]-(4-methylsulfanylphenyl)methanone

Systemtic Name: [1-[(1-methylpyrazol-4-yl)methyl]piperidin-3-yl]-(4-methylsulfanylphenyl)methanone Openeye Name: [1-[(1-methylpyrazol-4-yl)methyl]-3-piperidyl]-(4-methylsulfanylphenyl)methanone CAS Name: [1-[(1-methyl-4-pyrazolyl)methyl]-3-piperidinyl]-[4-(methylthio)phenyl]methanone IUPAC Name: [1-[(1-methylpyrazol-4-yl)methyl]piperidin-3-yl]-(4-methylsulfanylphenyl)methanone Traditional Name: [1-[(1-methylpyrazol-4-yl)methyl]-3-piperidyl]-[4-(methylthio)phenyl]methanone Formula: C18H23N3OS MolecularWeight: 329.45972

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CN2CCCC(C2)C(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CN1C=C(C=N1)CN2CCCC(C2)C(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C18H23N3OS/c1-20-11-14(10-19-20)12-21-9-3-4-16(13-21)18(22)15-5-7-17(23-2)8-6-15/h5-8,10-11,16H,3-4,9,12-13H2,1-2H3