3-(1,3-benzodioxol-5-ylmethyl)-6,7-dimethoxy-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-6,7-dimethoxy-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-6,7-dimethoxy-2-thioxo-1H-quinazolin-4-one CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-6,7-dimethoxy-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-6,7-dimethoxy-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 6,7-dimethoxy-3-piperonyl-2-thioxo-1H-quinazolin-4-one Formula: C18H16N2O5S MolecularWeight: 372.39504

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N(C(=S)N2)CC3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N(C(=S)N2)CC3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C18H16N2O5S/c1-22-14-6-11-12(7-15(14)23-2)19-18(26)20(17(11)21)8-10-3-4-13-16(5-10)25-9-24-13/h3-7H,8-9H2,1-2H3,(H,19,26)