ethyl 4,5-dimethyl-2-[2-(7-nitro-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4,5-dimethyl-2-[2-(7-nitro-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4,5-dimethyl-2-[[2-(7-nitro-4-oxo-quinazolin-3-yl)acetyl]amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[2-(7-nitro-4-oxo-3-quinazolinyl)-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dimethyl-2-[[2-(7-nitro-4-oxoquinazolin-3-yl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-(4-keto-7-nitro-quinazolin-3-yl)acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C19H18N4O6S MolecularWeight: 430.43442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CN2C=NC3=C(C2=O)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CN2C=NC3=C(C2=O)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O6S/c1-4-29-19(26)16-10(2)11(3)30-17(16)21-15(24)8-22-9-20-14-7-12(23(27)28)5-6-13(14)18(22)25/h5-7,9H,4,8H2,1-3H3,(H,21,24)