4-(1,3-benzodioxol-5-ylmethyl)-7,7-dimethyl-2-sulfanylidene-3,4,6,8-tetrahydro-1H-quinazolin-5-one

Systemtic Name: 4-(1,3-benzodioxol-5-ylmethyl)-7,7-dimethyl-2-sulfanylidene-3,4,6,8-tetrahydro-1H-quinazolin-5-one Openeye Name: 4-(1,3-benzodioxol-5-ylmethyl)-7,7-dimethyl-2-thioxo-3,4,6,8-tetrahydro-1H-quinazolin-5-one CAS Name: 4-(1,3-benzodioxol-5-ylmethyl)-7,7-dimethyl-2-sulfanylidene-3,4,6,8-tetrahydro-1H-quinazolin-5-one IUPAC Name: 4-(1,3-benzodioxol-5-ylmethyl)-7,7-dimethyl-2-sulfanylidene-3,4,6,8-tetrahydro-1H-quinazolin-5-one Traditional Name: 7,7-dimethyl-4-piperonyl-2-thioxo-3,4,6,8-tetrahydro-1H-quinazolin-5-one Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(NC(=S)N2)CC3=CC4=C(C=C3)OCO4)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(NC(=S)N2)CC3=CC4=C(C=C3)OCO4)C(=O)C1)C

InChI

InChI=1S/C18H20N2O3S/c1-18(2)7-12-16(13(21)8-18)11(19-17(24)20-12)5-10-3-4-14-15(6-10)23-9-22-14/h3-4,6,11H,5,7-9H2,1-2H3,(H2,19,20,24)