1-([1]benzofuro[3,2-d]pyrimidin-4-yl)-N-[(4-methylsulfanylphenyl)methyl]piperidine-3-carboxamide

Systemtic Name: 1-([1]benzofuro[3,2-d]pyrimidin-4-yl)-N-[(4-methylsulfanylphenyl)methyl]piperidine-3-carboxamide Openeye Name: 1-(benzofuro[3,2-d]pyrimidin-4-yl)-N-[(4-methylsulfanylphenyl)methyl]piperidine-3-carboxamide CAS Name: 1-(4-benzofuro[3,2-d]pyrimidinyl)-N-[[4-(methylthio)phenyl]methyl]-3-piperidinecarboxamide IUPAC Name: 1-([1]benzofuro[3,2-d]pyrimidin-4-yl)-N-[(4-methylsulfanylphenyl)methyl]piperidine-3-carboxamide Traditional Name: 1-(benzofuro[3,2-d]pyrimidin-4-yl)-N-[4-(methylthio)benzyl]nipecotamide Formula: C24H24N4O2S MolecularWeight: 432.53796

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CNC(=O)C2CCCN(C2)C3=NC=NC4=C3OC5=CC=CC=C54

Isomeric SMILES

CSC1=CC=C(C=C1)CNC(=O)C2CCCN(C2)C3=NC=NC4=C3OC5=CC=CC=C54

InChI

InChI=1S/C24H24N4O2S/c1-31-18-10-8-16(9-11-18)13-25-24(29)17-5-4-12-28(14-17)23-22-21(26-15-27-23)19-6-2-3-7-20(19)30-22/h2-3,6-11,15,17H,4-5,12-14H2,1H3,(H,25,29)