[(3S)-1-(1H-indazol-3-ylcarbonyl)piperidin-3-yl]-(4-methylsulfanylphenyl)methanone

Systemtic Name: [(3S)-1-(1H-indazol-3-ylcarbonyl)piperidin-3-yl]-(4-methylsulfanylphenyl)methanone Openeye Name: [(3S)-1-(1H-indazole-3-carbonyl)-3-piperidyl]-(4-methylsulfanylphenyl)methanone CAS Name: [(3S)-1-[1H-indazol-3-yl(oxo)methyl]-3-piperidinyl]-[4-(methylthio)phenyl]methanone IUPAC Name: [(3S)-1-(1H-indazole-3-carbonyl)piperidin-3-yl]-(4-methylsulfanylphenyl)methanone Traditional Name: [(3S)-1-(1H-indazole-3-carbonyl)-3-piperidyl]-[4-(methylthio)phenyl]methanone Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)C2CCCN(C2)C(=O)C3=NNC4=CC=CC=C43

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)[C@H]2CCCN(C2)C(=O)C3=NNC4=CC=CC=C43

InChI

InChI=1S/C21H21N3O2S/c1-27-16-10-8-14(9-11-16)20(25)15-5-4-12-24(13-15)21(26)19-17-6-2-3-7-18(17)22-23-19/h2-3,6-11,15H,4-5,12-13H2,1H3,(H,22,23)/t15-/m0/s1