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

Systemtic Name: dimethyl 3-methyl-5-[2-(7-nitro-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-methyl-5-[[2-(7-nitro-4-oxo-quinazolin-3-yl)acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[2-(7-nitro-4-oxo-3-quinazolinyl)-1-oxoethyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-[[2-(7-nitro-4-oxoquinazolin-3-yl)acetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 5-[[2-(4-keto-7-nitro-quinazolin-3-yl)acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C19H16N4O8S MolecularWeight: 460.41734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CN2C=NC3=C(C2=O)C=CC(=C3)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CN2C=NC3=C(C2=O)C=CC(=C3)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C19H16N4O8S/c1-9-14(18(26)30-2)16(32-15(9)19(27)31-3)21-13(24)7-22-8-20-12-6-10(23(28)29)4-5-11(12)17(22)25/h4-6,8H,7H2,1-3H3,(H,21,24)