ethyl 5-azanyl-4-cyano-3-[[1-(4-hydroxyphenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[[1-(4-hydroxyphenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[[1-(4-hydroxyphenyl)tetrazol-5-yl]sulfanylmethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[[1-(4-hydroxyphenyl)-5-tetrazolyl]thio]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[[1-(4-hydroxyphenyl)tetrazol-5-yl]sulfanylmethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[[[1-(4-hydroxyphenyl)tetrazol-5-yl]thio]methyl]thiophene-2-carboxylic acid ethyl ester Formula: C16H14N6O3S2 MolecularWeight: 402.45076

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)CSC2=NN=NN2C3=CC=C(C=C3)O

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)CSC2=NN=NN2C3=CC=C(C=C3)O

InChI

InChI=1S/C16H14N6O3S2/c1-2-25-15(24)13-12(11(7-17)14(18)27-13)8-26-16-19-20-21-22(16)9-3-5-10(23)6-4-9/h3-6,23H,2,8,18H2,1H3