(2-methylsulfanylpyridin-3-yl)-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: (2-methylsulfanylpyridin-3-yl)-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-(2-methylsulfanyl-3-pyridyl)methanone CAS Name: [2-(methylthio)-3-pyridinyl]-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-(2-methylsulfanylpyridin-3-yl)methanone Traditional Name: (4-benzylpiperazino)-[2-(methylthio)-3-pyridyl]methanone Formula: C18H21N3OS MolecularWeight: 327.44384

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)N2CCN(CC2)CC3=CC=CC=C3

InChI

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