propan-2-yl 5-(diethylcarbamoyl)-4-methyl-2-[2-(4-nitrophenyl)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: propan-2-yl 5-(diethylcarbamoyl)-4-methyl-2-[2-(4-nitrophenyl)ethanoylamino]thiophene-3-carboxylate Openeye Name: isopropyl 5-(diethylcarbamoyl)-4-methyl-2-[[2-(4-nitrophenyl)acetyl]amino]thiophene-3-carboxylate CAS Name: 5-[diethylamino(oxo)methyl]-4-methyl-2-[[2-(4-nitrophenyl)-1-oxoethyl]amino]-3-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 5-(diethylcarbamoyl)-4-methyl-2-[[2-(4-nitrophenyl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 5-(diethylcarbamoyl)-4-methyl-2-[[2-(4-nitrophenyl)acetyl]amino]thiophene-3-carboxylic acid isopropyl ester Formula: C22H27N3O6S MolecularWeight: 461.53128

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC(C)C)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC(C)C)C

InChI

InChI=1S/C22H27N3O6S/c1-6-24(7-2)21(27)19-14(5)18(22(28)31-13(3)4)20(32-19)23-17(26)12-15-8-10-16(11-9-15)25(29)30/h8-11,13H,6-7,12H2,1-5H3,(H,23,26)