methyl 3-azanyl-4-cyano-5-[(4-cyano-2-methoxycarbonyl-5-methylsulfonyl-thiophen-3-yl)amino]thiophene-2-carboxylate

Systemtic Name: methyl 3-azanyl-4-cyano-5-[(4-cyano-2-methoxycarbonyl-5-methylsulfonyl-thiophen-3-yl)amino]thiophene-2-carboxylate Openeye Name: methyl 3-amino-4-cyano-5-[(4-cyano-2-methoxycarbonyl-5-methylsulfonyl-3-thienyl)amino]thiophene-2-carboxylate CAS Name: 3-amino-4-cyano-5-[(4-cyano-2-methoxycarbonyl-5-methylsulfonyl-3-thiophenyl)amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-amino-4-cyano-5-[(4-cyano-2-methoxycarbonyl-5-methylsulfonylthiophen-3-yl)amino]thiophene-2-carboxylate Traditional Name: 3-amino-5-[(2-carbomethoxy-4-cyano-5-mesyl-3-thienyl)amino]-4-cyano-thiophene-2-carboxylic acid methyl ester Formula: C15H12N4O6S3 MolecularWeight: 440.47398

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=C(S1)NC2=C(SC(=C2C#N)S(=O)(=O)C)C(=O)OC)C#N)N

Isomeric SMILES

COC(=O)C1=C(C(=C(S1)NC2=C(SC(=C2C#N)S(=O)(=O)C)C(=O)OC)C#N)N

InChI

InChI=1S/C15H12N4O6S3/c1-24-13(20)10-8(18)6(4-16)12(26-10)19-9-7(5-17)15(28(3,22)23)27-11(9)14(21)25-2/h19H,18H2,1-3H3