3-(1,3-benzodioxol-5-ylmethyl)-7-methoxy-6-methylsulfanyl-quinazolin-4-one

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-7-methoxy-6-methylsulfanyl-quinazolin-4-one Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-7-methoxy-6-methylsulfanyl-quinazolin-4-one CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-7-methoxy-6-(methylthio)-4-quinazolinone IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-7-methoxy-6-methylsulfanylquinazolin-4-one Traditional Name: 7-methoxy-6-(methylthio)-3-piperonyl-quinazolin-4-one Formula: C18H16N2O4S MolecularWeight: 356.39564

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=CN(C2=O)CC3=CC4=C(C=C3)OCO4)SC

Isomeric SMILES

COC1=C(C=C2C(=C1)N=CN(C2=O)CC3=CC4=C(C=C3)OCO4)SC

InChI

InChI=1S/C18H16N2O4S/c1-22-16-7-13-12(6-17(16)25-2)18(21)20(9-19-13)8-11-3-4-14-15(5-11)24-10-23-14/h3-7,9H,8,10H2,1-2H3