ethyl 2-[2-(3,6-dimethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoylamino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(3,6-dimethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoylamino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(3,6-dimethyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]amino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate CAS Name: 2-[[2-[(3,6-dimethyl-4-oxo-2-quinazolinyl)thio]-1-oxoethyl]amino]-4-methyl-5-(methylcarbamoyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(3,6-dimethyl-4-oxoquinazolin-2-yl)sulfanylacetyl]amino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate Traditional Name: 2-[[2-[(4-keto-3,6-dimethyl-quinazolin-2-yl)thio]acetyl]amino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylic acid ethyl ester Formula: C22H24N4O5S2 MolecularWeight: 488.57976

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC)NC(=O)CSC2=NC3=C(C=C(C=C3)C)C(=O)N2C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC)NC(=O)CSC2=NC3=C(C=C(C=C3)C)C(=O)N2C

InChI

InChI=1S/C22H24N4O5S2/c1-6-31-21(30)16-12(3)17(18(28)23-4)33-19(16)25-15(27)10-32-22-24-14-8-7-11(2)9-13(14)20(29)26(22)5/h7-9H,6,10H2,1-5H3,(H,23,28)(H,25,27)