ethyl 4-(6,7-dimethoxy-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)piperidine-1-carboxylate

Systemtic Name: ethyl 4-(6,7-dimethoxy-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)piperidine-1-carboxylate Openeye Name: ethyl 4-(6,7-dimethoxy-4-oxo-2-thioxo-1H-quinazolin-3-yl)piperidine-1-carboxylate CAS Name: 4-(6,7-dimethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(6,7-dimethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)piperidine-1-carboxylate Traditional Name: 4-(4-keto-6,7-dimethoxy-2-thioxo-1H-quinazolin-3-yl)piperidine-1-carboxylic acid ethyl ester Formula: C18H23N3O5S MolecularWeight: 393.45732

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)N2C(=O)C3=CC(=C(C=C3NC2=S)OC)OC

Isomeric SMILES

CCOC(=O)N1CCC(CC1)N2C(=O)C3=CC(=C(C=C3NC2=S)OC)OC

InChI

InChI=1S/C18H23N3O5S/c1-4-26-18(23)20-7-5-11(6-8-20)21-16(22)12-9-14(24-2)15(25-3)10-13(12)19-17(21)27/h9-11H,4-8H2,1-3H3,(H,19,27)