[1-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)methyl]piperidin-3-yl]-(4-methylsulfanylphenyl)methanone

Systemtic Name: [1-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)methyl]piperidin-3-yl]-(4-methylsulfanylphenyl)methanone Openeye Name: [1-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)methyl]-3-piperidyl]-(4-methylsulfanylphenyl)methanone CAS Name: [1-[(5-chloro-1,3-dimethyl-4-pyrazolyl)methyl]-3-piperidinyl]-[4-(methylthio)phenyl]methanone IUPAC Name: [1-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]piperidin-3-yl]-(4-methylsulfanylphenyl)methanone Traditional Name: [1-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)methyl]-3-piperidyl]-[4-(methylthio)phenyl]methanone Formula: C19H24ClN3OS MolecularWeight: 377.93136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CN2CCCC(C2)C(=O)C3=CC=C(C=C3)SC)Cl)C

Isomeric SMILES

CC1=NN(C(=C1CN2CCCC(C2)C(=O)C3=CC=C(C=C3)SC)Cl)C

InChI

InChI=1S/C19H24ClN3OS/c1-13-17(19(20)22(2)21-13)12-23-10-4-5-15(11-23)18(24)14-6-8-16(25-3)9-7-14/h6-9,15H,4-5,10-12H2,1-3H3