ethyl 5-ethyl-2-[2-(4-oxidanylidene-3-pyridin-3-yl-quinazolin-2-yl)sulfanylethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-2-[2-(4-oxidanylidene-3-pyridin-3-yl-quinazolin-2-yl)sulfanylethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-[[2-[4-oxo-3-(3-pyridyl)quinazolin-2-yl]sulfanylacetyl]amino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[1-oxo-2-[[4-oxo-3-(3-pyridinyl)-2-quinazolinyl]thio]ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-[[2-(4-oxo-3-pyridin-3-ylquinazolin-2-yl)sulfanylacetyl]amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[[2-[[4-keto-3-(3-pyridyl)quinazolin-2-yl]thio]acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C24H22N4O4S2 MolecularWeight: 494.58588

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CN=CC=C4)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CN=CC=C4)C(=O)OCC

InChI

InChI=1S/C24H22N4O4S2/c1-3-16-12-18(23(31)32-4-2)21(34-16)27-20(29)14-33-24-26-19-10-6-5-9-17(19)22(30)28(24)15-8-7-11-25-13-15/h5-13H,3-4,14H2,1-2H3,(H,27,29)