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

Systemtic Name: [1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperidin-3-yl]-(4-methylsulfanylphenyl)methanone Openeye Name: [1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-3-piperidyl]-(4-methylsulfanylphenyl)methanone CAS Name: [1-[(1-ethyl-3-methyl-4-pyrazolyl)methyl]-3-piperidinyl]-[4-(methylthio)phenyl]methanone IUPAC Name: [1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]piperidin-3-yl]-(4-methylsulfanylphenyl)methanone Traditional Name: [1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-3-piperidyl]-[4-(methylthio)phenyl]methanone Formula: C20H27N3OS MolecularWeight: 357.51288

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)CN2CCCC(C2)C(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CCN1C=C(C(=N1)C)CN2CCCC(C2)C(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C20H27N3OS/c1-4-23-14-18(15(2)21-23)13-22-11-5-6-17(12-22)20(24)16-7-9-19(25-3)10-8-16/h7-10,14,17H,4-6,11-13H2,1-3H3