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

Systemtic Name: diethyl 3-methyl-5-[2-(7-nitro-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 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 diethyl ester IUPAC Name: diethyl 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 diethyl ester Formula: C21H20N4O8S MolecularWeight: 488.4705

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N4O8S/c1-4-32-20(28)16-11(3)17(21(29)33-5-2)34-18(16)23-15(26)9-24-10-22-14-8-12(25(30)31)6-7-13(14)19(24)27/h6-8,10H,4-5,9H2,1-3H3,(H,23,26)