ethyl 3-methyl-5-[(2-morpholin-4-yl-5-piperidin-1-ylsulfonyl-phenyl)carbonylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 3-methyl-5-[(2-morpholin-4-yl-5-piperidin-1-ylsulfonyl-phenyl)carbonylamino]thiophene-2-carboxylate Openeye Name: ethyl 3-methyl-5-[[2-morpholino-5-(1-piperidylsulfonyl)benzoyl]amino]thiophene-2-carboxylate CAS Name: 3-methyl-5-[[[2-(4-morpholinyl)-5-(1-piperidinylsulfonyl)phenyl]-oxomethyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-5-[(2-morpholin-4-yl-5-piperidin-1-ylsulfonylbenzoyl)amino]thiophene-2-carboxylate Traditional Name: 3-methyl-5-[(2-morpholino-5-piperidinosulfonyl-benzoyl)amino]thiophene-2-carboxylic acid ethyl ester Formula: C24H31N3O6S2 MolecularWeight: 521.64944

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)N4CCOCC4)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)N4CCOCC4)C

InChI

InChI=1S/C24H31N3O6S2/c1-3-33-24(29)22-17(2)15-21(34-22)25-23(28)19-16-18(35(30,31)27-9-5-4-6-10-27)7-8-20(19)26-11-13-32-14-12-26/h7-8,15-16H,3-6,9-14H2,1-2H3,(H,25,28)