ethyl 4-[7-(4-aminocarbonylpiperidin-1-yl)carbonyl-4-oxidanylidene-3-pentyl-quinazolin-2-yl]sulfanyl-3-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[7-(4-aminocarbonylpiperidin-1-yl)carbonyl-4-oxidanylidene-3-pentyl-quinazolin-2-yl]sulfanyl-3-oxidanylidene-butanoate Openeye Name: ethyl 4-[7-(4-carbamoylpiperidine-1-carbonyl)-4-oxo-3-pentyl-quinazolin-2-yl]sulfanyl-3-oxo-butanoate CAS Name: 4-[[7-[(4-carbamoyl-1-piperidinyl)-oxomethyl]-4-oxo-3-pentyl-2-quinazolinyl]thio]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[7-(4-carbamoylpiperidine-1-carbonyl)-4-oxo-3-pentylquinazolin-2-yl]sulfanyl-3-oxobutanoate Traditional Name: 4-[[3-amyl-7-(4-carbamoylpiperidine-1-carbonyl)-4-keto-quinazolin-2-yl]thio]-3-keto-butyric acid ethyl ester Formula: C26H34N4O6S MolecularWeight: 530.63636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCC(CC3)C(=O)N)N=C1SCC(=O)CC(=O)OCC

Isomeric SMILES

CCCCCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCC(CC3)C(=O)N)N=C1SCC(=O)CC(=O)OCC

InChI

InChI=1S/C26H34N4O6S/c1-3-5-6-11-30-25(35)20-8-7-18(24(34)29-12-9-17(10-13-29)23(27)33)14-21(20)28-26(30)37-16-19(31)15-22(32)36-4-2/h7-8,14,17H,3-6,9-13,15-16H2,1-2H3,(H2,27,33)