3-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-phenacylsulfanyl-quinazolin-4-one

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-phenacylsulfanyl-quinazolin-4-one Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-phenacylsulfanyl-quinazolin-4-one CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-(phenacylthio)-4-quinazolinone IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-phenacylsulfanylquinazolin-4-one Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-(phenacylthio)quinazolin-4-one Formula: C25H20N2O4S MolecularWeight: 444.5023

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)CN3C(=O)C4=CC=CC=C4N=C3SCC(=O)C5=CC=CC=C5

Isomeric SMILES

C1C(OC2=CC=CC=C2O1)CN3C(=O)C4=CC=CC=C4N=C3SCC(=O)C5=CC=CC=C5

InChI

InChI=1S/C25H20N2O4S/c28-21(17-8-2-1-3-9-17)16-32-25-26-20-11-5-4-10-19(20)24(29)27(25)14-18-15-30-22-12-6-7-13-23(22)31-18/h1-13,18H,14-16H2