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

Systemtic Name: 2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-N-(4-butylphenyl)ethanamide Openeye Name: 2-(benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-N-(4-butylphenyl)acetamide CAS Name: 2-(4-benzofuro[3,2-d]pyrimidinylthio)-N-(4-butylphenyl)acetamide IUPAC Name: 2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-N-(4-butylphenyl)acetamide Traditional Name: 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)-N-(4-butylphenyl)acetamide Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CSC2=NC=NC3=C2OC4=CC=CC=C43

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CSC2=NC=NC3=C2OC4=CC=CC=C43

InChI

InChI=1S/C22H21N3O2S/c1-2-3-6-15-9-11-16(12-10-15)25-19(26)13-28-22-21-20(23-14-24-22)17-7-4-5-8-18(17)27-21/h4-5,7-12,14H,2-3,6,13H2,1H3,(H,25,26)