ethyl 4-[4-oxidanylidene-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-quinazolin-3-yl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[4-oxidanylidene-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-quinazolin-3-yl]piperidine-1-carboxylate Openeye Name: ethyl 4-[4-oxo-2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-quinazolin-3-yl]piperidine-1-carboxylate CAS Name: 4-[4-oxo-2-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]-3-quinazolinyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-oxo-2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylquinazolin-3-yl]piperidine-1-carboxylate Traditional Name: 4-[4-keto-2-[(2-keto-2-pyrrolidino-ethyl)thio]quinazolin-3-yl]piperidine-1-carboxylic acid ethyl ester Formula: C22H28N4O4S MolecularWeight: 444.54712

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N4CCCC4

Isomeric SMILES

CCOC(=O)N1CCC(CC1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N4CCCC4

InChI

InChI=1S/C22H28N4O4S/c1-2-30-22(29)25-13-9-16(10-14-25)26-20(28)17-7-3-4-8-18(17)23-21(26)31-15-19(27)24-11-5-6-12-24/h3-4,7-8,16H,2,5-6,9-15H2,1H3