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

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]thiophene-2-carboxylic acid ethyl ester Formula: C13H15N5O2S3 MolecularWeight: 369.4855

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NN=C(S1)SCC2=C(SC(=C2C#N)N)C(=O)OCC

Isomeric SMILES

CCNC1=NN=C(S1)SCC2=C(SC(=C2C#N)N)C(=O)OCC

InChI

InChI=1S/C13H15N5O2S3/c1-3-16-12-17-18-13(23-12)21-6-8-7(5-14)10(15)22-9(8)11(19)20-4-2/h3-4,6,15H2,1-2H3,(H,16,17)