ethyl 5-azanyl-4-cyano-3-[[4-(2-ethoxy-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]sulfanylmethyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[[4-(2-ethoxy-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]sulfanylmethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[[4-(2-ethoxy-2-oxo-ethyl)thiazol-2-yl]sulfanylmethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[[4-(2-ethoxy-2-oxoethyl)-2-thiazolyl]thio]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[[4-(2-ethoxy-2-oxoethyl)-1,3-thiazol-2-yl]sulfanylmethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[[[4-(2-ethoxy-2-keto-ethyl)thiazol-2-yl]thio]methyl]thiophene-2-carboxylic acid ethyl ester Formula: C16H17N3O4S3 MolecularWeight: 411.51888

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)SCC2=C(SC(=C2C#N)N)C(=O)OCC

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)SCC2=C(SC(=C2C#N)N)C(=O)OCC

InChI

InChI=1S/C16H17N3O4S3/c1-3-22-12(20)5-9-7-24-16(19-9)25-8-11-10(6-17)14(18)26-13(11)15(21)23-4-2/h7H,3-5,8,18H2,1-2H3