ethyl 3-methyl-5-[[4-(2-methylpiperidin-1-yl)sulfonylphenyl]carbonylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 3-methyl-5-[[4-(2-methylpiperidin-1-yl)sulfonylphenyl]carbonylamino]thiophene-2-carboxylate Openeye Name: ethyl 3-methyl-5-[[4-[(2-methyl-1-piperidyl)sulfonyl]benzoyl]amino]thiophene-2-carboxylate CAS Name: 3-methyl-5-[[[4-[(2-methyl-1-piperidinyl)sulfonyl]phenyl]-oxomethyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-5-[[4-(2-methylpiperidin-1-yl)sulfonylbenzoyl]amino]thiophene-2-carboxylate Traditional Name: 3-methyl-5-[[4-(2-methylpiperidino)sulfonylbenzoyl]amino]thiophene-2-carboxylic acid ethyl ester Formula: C21H26N2O5S2 MolecularWeight: 450.57154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3C)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3C)C

InChI

InChI=1S/C21H26N2O5S2/c1-4-28-21(25)19-14(2)13-18(29-19)22-20(24)16-8-10-17(11-9-16)30(26,27)23-12-6-5-7-15(23)3/h8-11,13,15H,4-7,12H2,1-3H3,(H,22,24)