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

Systemtic Name: 2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-N-(3-methyl-4-pyrrolidin-1-yl-phenyl)ethanamide Openeye Name: 2-(benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-N-(3-methyl-4-pyrrolidin-1-yl-phenyl)acetamide CAS Name: 2-(4-benzofuro[3,2-d]pyrimidinylthio)-N-[3-methyl-4-(1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-N-(3-methyl-4-pyrrolidin-1-ylphenyl)acetamide Traditional Name: 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)-N-(3-methyl-4-pyrrolidino-phenyl)acetamide Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CSC2=NC=NC3=C2OC4=CC=CC=C43)N5CCCC5

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CSC2=NC=NC3=C2OC4=CC=CC=C43)N5CCCC5

InChI

InChI=1S/C23H22N4O2S/c1-15-12-16(8-9-18(15)27-10-4-5-11-27)26-20(28)13-30-23-22-21(24-14-25-23)17-6-2-3-7-19(17)29-22/h2-3,6-9,12,14H,4-5,10-11,13H2,1H3,(H,26,28)