2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-N-(4-pyrrolidin-1-ylphenyl)ethanamide

Systemtic Name: 2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-N-(4-pyrrolidin-1-ylphenyl)ethanamide Openeye Name: 2-(benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-N-(4-pyrrolidin-1-ylphenyl)acetamide CAS Name: 2-(4-benzofuro[3,2-d]pyrimidinylthio)-N-[4-(1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-N-(4-pyrrolidin-1-ylphenyl)acetamide Traditional Name: 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)-N-(4-pyrrolidinophenyl)acetamide Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=C(C=C2)NC(=O)CSC3=NC=NC4=C3OC5=CC=CC=C54

Isomeric SMILES

C1CCN(C1)C2=CC=C(C=C2)NC(=O)CSC3=NC=NC4=C3OC5=CC=CC=C54

InChI

InChI=1S/C22H20N4O2S/c27-19(25-15-7-9-16(10-8-15)26-11-3-4-12-26)13-29-22-21-20(23-14-24-22)17-5-1-2-6-18(17)28-21/h1-2,5-10,14H,3-4,11-13H2,(H,25,27)