ethyl 3-[2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: ethyl 3-[2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: ethyl 3-[[2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[2-[(4-ethyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[[2-[(4-ethyl-1,2,4-triazol-3-yl)thio]acetyl]amino]-5-phenyl-thiophene-2-carboxylic acid ethyl ester Formula: C19H20N4O3S2 MolecularWeight: 416.5171

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NN=C1SCC(=O)NC2=C(SC(=C2)C3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCN1C=NN=C1SCC(=O)NC2=C(SC(=C2)C3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C19H20N4O3S2/c1-3-23-12-20-22-19(23)27-11-16(24)21-14-10-15(13-8-6-5-7-9-13)28-17(14)18(25)26-4-2/h5-10,12H,3-4,11H2,1-2H3,(H,21,24)