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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O5S2/c1-4-28-21(25)19-14(2)12-18(29-19)22-20(24)16-9-7-10-17(13-16)30(26,27)23-11-6-5-8-15(23)3/h7,9-10,12-13,15H,4-6,8,11H2,1-3H3,(H,22,24)