1-[(2-methylsulfanylpyrimidin-5-yl)methyl]-N-[3-(1H-pyrazol-5-yl)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-[(2-methylsulfanylpyrimidin-5-yl)methyl]-N-[3-(1H-pyrazol-5-yl)phenyl]piperidine-4-carboxamide Openeye Name: 1-[(2-methylsulfanylpyrimidin-5-yl)methyl]-N-[3-(1H-pyrazol-5-yl)phenyl]piperidine-4-carboxamide CAS Name: 1-[[2-(methylthio)-5-pyrimidinyl]methyl]-N-[3-(1H-pyrazol-5-yl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-[(2-methylsulfanylpyrimidin-5-yl)methyl]-N-[3-(1H-pyrazol-5-yl)phenyl]piperidine-4-carboxamide Traditional Name: 1-[[2-(methylthio)pyrimidin-5-yl]methyl]-N-[3-(1H-pyrazol-5-yl)phenyl]isonipecotamide Formula: C21H24N6OS MolecularWeight: 408.51986

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C=N1)CN2CCC(CC2)C(=O)NC3=CC=CC(=C3)C4=CC=NN4

Isomeric SMILES

CSC1=NC=C(C=N1)CN2CCC(CC2)C(=O)NC3=CC=CC(=C3)C4=CC=NN4

InChI

InChI=1S/C21H24N6OS/c1-29-21-22-12-15(13-23-21)14-27-9-6-16(7-10-27)20(28)25-18-4-2-3-17(11-18)19-5-8-24-26-19/h2-5,8,11-13,16H,6-7,9-10,14H2,1H3,(H,24,26)(H,25,28)