N-(4-methylsulfanylphenyl)-1-pyrimidin-2-yl-piperidine-4-carboxamide

Systemtic Name: N-(4-methylsulfanylphenyl)-1-pyrimidin-2-yl-piperidine-4-carboxamide Openeye Name: N-(4-methylsulfanylphenyl)-1-pyrimidin-2-yl-piperidine-4-carboxamide CAS Name: N-[4-(methylthio)phenyl]-1-(2-pyrimidinyl)-4-piperidinecarboxamide IUPAC Name: N-(4-methylsulfanylphenyl)-1-pyrimidin-2-ylpiperidine-4-carboxamide Traditional Name: N-[4-(methylthio)phenyl]-1-(2-pyrimidyl)isonipecotamide Formula: C17H20N4OS MolecularWeight: 328.4319

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC(=O)C2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CSC1=CC=C(C=C1)NC(=O)C2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C17H20N4OS/c1-23-15-5-3-14(4-6-15)20-16(22)13-7-11-21(12-8-13)17-18-9-2-10-19-17/h2-6,9-10,13H,7-8,11-12H2,1H3,(H,20,22)