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

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-6-methylsulfanyl-quinazolin-4-one Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-6-methylsulfanyl-quinazolin-4-one CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-6-(methylthio)-4-quinazolinone IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-6-methylsulfanylquinazolin-4-one Traditional Name: 6-(methylthio)-3-piperonyl-quinazolin-4-one Formula: C17H14N2O3S MolecularWeight: 326.36966

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(C=C1)N=CN(C2=O)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CSC1=CC2=C(C=C1)N=CN(C2=O)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H14N2O3S/c1-23-12-3-4-14-13(7-12)17(20)19(9-18-14)8-11-2-5-15-16(6-11)22-10-21-15/h2-7,9H,8,10H2,1H3