3-(1,3-benzodioxol-5-ylmethyl)-2-phenacylsulfanyl-quinazolin-4-one

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-phenacylsulfanyl-quinazolin-4-one Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-phenacylsulfanyl-quinazolin-4-one CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(phenacylthio)-4-quinazolinone IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-phenacylsulfanylquinazolin-4-one Traditional Name: 2-(phenacylthio)-3-piperonyl-quinazolin-4-one Formula: C24H18N2O4S MolecularWeight: 430.47572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4=CC=CC=C4N=C3SCC(=O)C5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4=CC=CC=C4N=C3SCC(=O)C5=CC=CC=C5

InChI

InChI=1S/C24H18N2O4S/c27-20(17-6-2-1-3-7-17)14-31-24-25-19-9-5-4-8-18(19)23(28)26(24)13-16-10-11-21-22(12-16)30-15-29-21/h1-12H,13-15H2