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

Systemtic Name: ethyl 3-[2-[(1-ethyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: ethyl 3-[[2-(1-ethyltetrazol-5-yl)sulfanylacetyl]amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[2-[(1-ethyl-5-tetrazolyl)thio]-1-oxoethyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-(1-ethyltetrazol-5-yl)sulfanylacetyl]amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[[2-[(1-ethyltetrazol-5-yl)thio]acetyl]amino]-5-phenyl-thiophene-2-carboxylic acid ethyl ester Formula: C18H19N5O3S2 MolecularWeight: 417.50516

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=N1)SCC(=O)NC2=C(SC(=C2)C3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCN1C(=NN=N1)SCC(=O)NC2=C(SC(=C2)C3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C18H19N5O3S2/c1-3-23-18(20-21-22-23)27-11-15(24)19-13-10-14(12-8-6-5-7-9-12)28-16(13)17(25)26-4-2/h5-10H,3-4,11H2,1-2H3,(H,19,24)