ethyl 4-[3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanoylamino]piperidine-1-carboxylate CAS Name: 4-[[1-oxo-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanoylamino]piperidine-1-carboxylate Traditional Name: 4-[3-(4-keto-2-thioxo-1H-quinazolin-3-yl)propanoylamino]piperidine-1-carboxylic acid ethyl ester Formula: C19H24N4O4S MolecularWeight: 404.48326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CCN2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CCN2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C19H24N4O4S/c1-2-27-19(26)22-10-7-13(8-11-22)20-16(24)9-12-23-17(25)14-5-3-4-6-15(14)21-18(23)28/h3-6,13H,2,7-12H2,1H3,(H,20,24)(H,21,28)