ethyl 2-[2-(2-methyl-1,3-thiazol-4-yl)ethanoylamino]-4-(3-nitrophenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(2-methyl-1,3-thiazol-4-yl)ethanoylamino]-4-(3-nitrophenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(2-methylthiazol-4-yl)acetyl]amino]-4-(3-nitrophenyl)thiophene-3-carboxylate CAS Name: 2-[[2-(2-methyl-4-thiazolyl)-1-oxoethyl]amino]-4-(3-nitrophenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(2-methyl-1,3-thiazol-4-yl)acetyl]amino]-4-(3-nitrophenyl)thiophene-3-carboxylate Traditional Name: 2-[[2-(2-methylthiazol-4-yl)acetyl]amino]-4-(3-nitrophenyl)thiophene-3-carboxylic acid ethyl ester Formula: C19H17N3O5S2 MolecularWeight: 431.48538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)CC3=CSC(=N3)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)CC3=CSC(=N3)C

InChI

InChI=1S/C19H17N3O5S2/c1-3-27-19(24)17-15(12-5-4-6-14(7-12)22(25)26)10-29-18(17)21-16(23)8-13-9-28-11(2)20-13/h4-7,9-10H,3,8H2,1-2H3,(H,21,23)