ethyl 2-[2-[(4-cyanophenyl)sulfonyl-methyl-amino]ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[(4-cyanophenyl)sulfonyl-methyl-amino]ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[(4-cyanophenyl)sulfonyl-methyl-amino]acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[2-[(4-cyanophenyl)sulfonyl-methylamino]-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[(4-cyanophenyl)sulfonyl-methylamino]acetyl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[2-[(4-cyanophenyl)sulfonyl-methyl-amino]acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C19H21N3O5S2 MolecularWeight: 435.51714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CN(C)S(=O)(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CN(C)S(=O)(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C19H21N3O5S2/c1-5-27-19(24)17-12(2)13(3)28-18(17)21-16(23)11-22(4)29(25,26)15-8-6-14(10-20)7-9-15/h6-9H,5,11H2,1-4H3,(H,21,23)