ethyl 4-methyl-5-(methylcarbamoyl)-2-[2-(2-methyl-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-methyl-5-(methylcarbamoyl)-2-[2-(2-methyl-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-methyl-5-(methylcarbamoyl)-2-[[2-(2-methyl-4-oxo-quinazolin-3-yl)acetyl]amino]thiophene-3-carboxylate CAS Name: 4-methyl-5-(methylcarbamoyl)-2-[[2-(2-methyl-4-oxo-3-quinazolinyl)-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-5-(methylcarbamoyl)-2-[[2-(2-methyl-4-oxoquinazolin-3-yl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-(4-keto-2-methyl-quinazolin-3-yl)acetyl]amino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylic acid ethyl ester Formula: C21H22N4O5S MolecularWeight: 442.48818

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC)NC(=O)CN2C(=NC3=CC=CC=C3C2=O)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC)NC(=O)CN2C(=NC3=CC=CC=C3C2=O)C

InChI

InChI=1S/C21H22N4O5S/c1-5-30-21(29)16-11(2)17(18(27)22-4)31-19(16)24-15(26)10-25-12(3)23-14-9-7-6-8-13(14)20(25)28/h6-9H,5,10H2,1-4H3,(H,22,27)(H,24,26)