ethyl 5-ethyl-4-methyl-2-[2-(6-nitroindazol-1-yl)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-4-methyl-2-[2-(6-nitroindazol-1-yl)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-4-methyl-2-[[2-(6-nitroindazol-1-yl)acetyl]amino]thiophene-3-carboxylate CAS Name: 5-ethyl-4-methyl-2-[[2-(6-nitro-1-indazolyl)-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-4-methyl-2-[[2-(6-nitroindazol-1-yl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-4-methyl-2-[[2-(6-nitroindazol-1-yl)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C19H20N4O5S MolecularWeight: 416.4509

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(S1)NC(=O)CN2C3=C(C=CC(=C3)[N+](=O)[O-])C=N2)C(=O)OCC)C

Isomeric SMILES

CCC1=C(C(=C(S1)NC(=O)CN2C3=C(C=CC(=C3)[N+](=O)[O-])C=N2)C(=O)OCC)C

InChI

InChI=1S/C19H20N4O5S/c1-4-15-11(3)17(19(25)28-5-2)18(29-15)21-16(24)10-22-14-8-13(23(26)27)7-6-12(14)9-20-22/h6-9H,4-5,10H2,1-3H3,(H,21,24)