(3-methylsulfanyl-1-phenyl-pyrazol-4-yl)-piperidin-1-yl-methanone

Systemtic Name: (3-methylsulfanyl-1-phenyl-pyrazol-4-yl)-piperidin-1-yl-methanone Openeye Name: (3-methylsulfanyl-1-phenyl-pyrazol-4-yl)-(1-piperidyl)methanone CAS Name: [3-(methylthio)-1-phenyl-4-pyrazolyl]-(1-piperidinyl)methanone IUPAC Name: (3-methylsulfanyl-1-phenylpyrazol-4-yl)-piperidin-1-ylmethanone Traditional Name: [3-(methylthio)-1-phenyl-pyrazol-4-yl]-piperidino-methanone Formula: C16H19N3OS MolecularWeight: 301.40656

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN(C=C1C(=O)N2CCCCC2)C3=CC=CC=C3

Isomeric SMILES

CSC1=NN(C=C1C(=O)N2CCCCC2)C3=CC=CC=C3

InChI

InChI=1S/C16H19N3OS/c1-21-15-14(16(20)18-10-6-3-7-11-18)12-19(17-15)13-8-4-2-5-9-13/h2,4-5,8-9,12H,3,6-7,10-11H2,1H3