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

Systemtic Name: N-[4-(furan-2-yl)phenyl]-1-[(2-methylsulfanylpyrimidin-5-yl)methyl]piperidine-3-carboxamide Openeye Name: N-[4-(2-furyl)phenyl]-1-[(2-methylsulfanylpyrimidin-5-yl)methyl]piperidine-3-carboxamide CAS Name: N-[4-(2-furanyl)phenyl]-1-[[2-(methylthio)-5-pyrimidinyl]methyl]-3-piperidinecarboxamide IUPAC Name: N-[4-(furan-2-yl)phenyl]-1-[(2-methylsulfanylpyrimidin-5-yl)methyl]piperidine-3-carboxamide Traditional Name: N-[4-(2-furyl)phenyl]-1-[[2-(methylthio)pyrimidin-5-yl]methyl]nipecotamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C=N1)CN2CCCC(C2)C(=O)NC3=CC=C(C=C3)C4=CC=CO4

Isomeric SMILES

CSC1=NC=C(C=N1)CN2CCCC(C2)C(=O)NC3=CC=C(C=C3)C4=CC=CO4

InChI

InChI=1S/C22H24N4O2S/c1-29-22-23-12-16(13-24-22)14-26-10-2-4-18(15-26)21(27)25-19-8-6-17(7-9-19)20-5-3-11-28-20/h3,5-9,11-13,18H,2,4,10,14-15H2,1H3,(H,25,27)