ethyl 4-ethyl-5-methyl-2-[2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-ethyl-5-methyl-2-[2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-ethyl-5-methyl-2-[[2-(4-oxo-1,2,3-benzotriazin-3-yl)acetyl]amino]thiophene-3-carboxylate CAS Name: 4-ethyl-5-methyl-2-[[1-oxo-2-(4-oxo-1,2,3-benzotriazin-3-yl)ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-ethyl-5-methyl-2-[[2-(4-oxo-1,2,3-benzotriazin-3-yl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-ethyl-2-[[2-(4-keto-1,2,3-benzotriazin-3-yl)acetyl]amino]-5-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C19H20N4O4S MolecularWeight: 400.4515

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OCC)NC(=O)CN2C(=O)C3=CC=CC=C3N=N2)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OCC)NC(=O)CN2C(=O)C3=CC=CC=C3N=N2)C

InChI

InChI=1S/C19H20N4O4S/c1-4-12-11(3)28-17(16(12)19(26)27-5-2)20-15(24)10-23-18(25)13-8-6-7-9-14(13)21-22-23/h6-9H,4-5,10H2,1-3H3,(H,20,24)