ethyl 5-azanyl-4-cyano-3-[[5-(2,2-dimethylpropanoylamino)-3-methyl-thiophen-2-yl]carbonyloxymethyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[[5-(2,2-dimethylpropanoylamino)-3-methyl-thiophen-2-yl]carbonyloxymethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[[5-(2,2-dimethylpropanoylamino)-3-methyl-thiophene-2-carbonyl]oxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[[5-[(2,2-dimethyl-1-oxopropyl)amino]-3-methyl-2-thiophenyl]-oxomethoxy]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[[5-(2,2-dimethylpropanoylamino)-3-methylthiophene-2-carbonyl]oxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[[3-methyl-5-(pivaloylamino)thiophene-2-carbonyl]oxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C20H23N3O5S2 MolecularWeight: 449.54372

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=C(C=C(S2)NC(=O)C(C)(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=C(C=C(S2)NC(=O)C(C)(C)C)C

InChI

InChI=1S/C20H23N3O5S2/c1-6-27-18(25)15-12(11(8-21)16(22)30-15)9-28-17(24)14-10(2)7-13(29-14)23-19(26)20(3,4)5/h7H,6,9,22H2,1-5H3,(H,23,26)