(2-methylsulfanylpyridin-3-yl)-[4-(pyridin-4-ylmethyl)piperidin-1-yl]methanone

Systemtic Name: (2-methylsulfanylpyridin-3-yl)-[4-(pyridin-4-ylmethyl)piperidin-1-yl]methanone Openeye Name: (2-methylsulfanyl-3-pyridyl)-[4-(4-pyridylmethyl)-1-piperidyl]methanone CAS Name: [2-(methylthio)-3-pyridinyl]-[4-(pyridin-4-ylmethyl)-1-piperidinyl]methanone IUPAC Name: (2-methylsulfanylpyridin-3-yl)-[4-(pyridin-4-ylmethyl)piperidin-1-yl]methanone Traditional Name: [2-(methylthio)-3-pyridyl]-[4-(4-pyridylmethyl)piperidino]methanone Formula: C18H21N3OS MolecularWeight: 327.44384

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)N2CCC(CC2)CC3=CC=NC=C3

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)N2CCC(CC2)CC3=CC=NC=C3

InChI

InChI=1S/C18H21N3OS/c1-23-17-16(3-2-8-20-17)18(22)21-11-6-15(7-12-21)13-14-4-9-19-10-5-14/h2-5,8-10,15H,6-7,11-13H2,1H3