ethyl 5-aminocarbonyl-2-[2-(4-tert-butylphenyl)sulfanylethanoylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-aminocarbonyl-2-[2-(4-tert-butylphenyl)sulfanylethanoylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(4-tert-butylphenyl)sulfanylacetyl]amino]-5-carbamoyl-4-methyl-thiophene-3-carboxylate CAS Name: 2-[[2-[(4-tert-butylphenyl)thio]-1-oxoethyl]amino]-5-carbamoyl-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(4-tert-butylphenyl)sulfanylacetyl]amino]-5-carbamoyl-4-methylthiophene-3-carboxylate Traditional Name: 2-[[2-[(4-tert-butylphenyl)thio]acetyl]amino]-5-carbamoyl-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H26N2O4S2 MolecularWeight: 434.57214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)CSC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)CSC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C21H26N2O4S2/c1-6-27-20(26)16-12(2)17(18(22)25)29-19(16)23-15(24)11-28-14-9-7-13(8-10-14)21(3,4)5/h7-10H,6,11H2,1-5H3,(H2,22,25)(H,23,24)