2-[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl]sulfanyl-5,6,7,8-tetrahydro-1H-quinazolin-4-one

Systemtic Name: 2-[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl]sulfanyl-5,6,7,8-tetrahydro-1H-quinazolin-4-one Openeye Name: 2-[2-(1,3-benzodioxol-5-yl)-2-oxo-ethyl]sulfanyl-5,6,7,8-tetrahydro-1H-quinazolin-4-one CAS Name: 2-[[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]thio]-5,6,7,8-tetrahydro-1H-quinazolin-4-one IUPAC Name: 2-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]sulfanyl-5,6,7,8-tetrahydro-1H-quinazolin-4-one Traditional Name: 2-[[2-(1,3-benzodioxol-5-yl)-2-keto-ethyl]thio]-5,6,7,8-tetrahydro-1H-quinazolin-4-one Formula: C17H16N2O4S MolecularWeight: 344.38494

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=O)N=C(N2)SCC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCC2=C(C1)C(=O)N=C(N2)SCC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H16N2O4S/c20-13(10-5-6-14-15(7-10)23-9-22-14)8-24-17-18-12-4-2-1-3-11(12)16(21)19-17/h5-7H,1-4,8-9H2,(H,18,19,21)