6,7-dimethoxy-3-[2-(2-methylpiperidin-1-ium-1-yl)ethyl]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 6,7-dimethoxy-3-[2-(2-methylpiperidin-1-ium-1-yl)ethyl]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 6,7-dimethoxy-3-[2-(2-methylpiperidin-1-ium-1-yl)ethyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 6,7-dimethoxy-3-[2-(2-methyl-1-piperidin-1-iumyl)ethyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 6,7-dimethoxy-3-[2-(2-methylpiperidin-1-ium-1-yl)ethyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 6,7-dimethoxy-3-[2-(2-methylpiperidin-1-ium-1-yl)ethyl]-2-thioxo-1H-quinazolin-4-one Formula: C18H26N3O3S+ MolecularWeight: 364.48234

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCN2C(=O)C3=CC(=C(C=C3NC2=S)OC)OC

Isomeric SMILES

CC1CCCC[NH+]1CCN2C(=O)C3=CC(=C(C=C3NC2=S)OC)OC

InChI

InChI=1S/C18H25N3O3S/c1-12-6-4-5-7-20(12)8-9-21-17(22)13-10-15(23-2)16(24-3)11-14(13)19-18(21)25/h10-12H,4-9H2,1-3H3,(H,19,25)/p+1