(4-methylsulfanylphenyl)-[1-(1H-pyrazol-5-ylmethyl)piperidin-3-yl]methanone

Systemtic Name: (4-methylsulfanylphenyl)-[1-(1H-pyrazol-5-ylmethyl)piperidin-3-yl]methanone Openeye Name: (4-methylsulfanylphenyl)-[1-(1H-pyrazol-5-ylmethyl)-3-piperidyl]methanone CAS Name: [4-(methylthio)phenyl]-[1-(1H-pyrazol-5-ylmethyl)-3-piperidinyl]methanone IUPAC Name: (4-methylsulfanylphenyl)-[1-(1H-pyrazol-5-ylmethyl)piperidin-3-yl]methanone Traditional Name: [4-(methylthio)phenyl]-[1-(1H-pyrazol-5-ylmethyl)-3-piperidyl]methanone Formula: C17H21N3OS MolecularWeight: 315.43314

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)C2CCCN(C2)CC3=CC=NN3

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)C2CCCN(C2)CC3=CC=NN3

InChI

InChI=1S/C17H21N3OS/c1-22-16-6-4-13(5-7-16)17(21)14-3-2-10-20(11-14)12-15-8-9-18-19-15/h4-9,14H,2-3,10-12H2,1H3,(H,18,19)