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

Systemtic Name: 2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-N-[2-(3-methylphenoxy)ethyl]ethanamide Openeye Name: 2-(benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-N-[2-(3-methylphenoxy)ethyl]acetamide CAS Name: 2-(4-benzofuro[3,2-d]pyrimidinylthio)-N-[2-(3-methylphenoxy)ethyl]acetamide IUPAC Name: 2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-N-[2-(3-methylphenoxy)ethyl]acetamide Traditional Name: 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)-N-[2-(3-methylphenoxy)ethyl]acetamide Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19N3O3S/c1-14-5-4-6-15(11-14)26-10-9-22-18(25)12-28-21-20-19(23-13-24-21)16-7-2-3-8-17(16)27-20/h2-8,11,13H,9-10,12H2,1H3,(H,22,25)