methyl 4,5-dimethyl-2-[3-(4-morpholin-4-ylsulfonylphenyl)propanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4,5-dimethyl-2-[3-(4-morpholin-4-ylsulfonylphenyl)propanoylamino]thiophene-3-carboxylate Openeye Name: methyl 4,5-dimethyl-2-[3-(4-morpholinosulfonylphenyl)propanoylamino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[3-[4-(4-morpholinylsulfonyl)phenyl]-1-oxopropyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4,5-dimethyl-2-[3-(4-morpholin-4-ylsulfonylphenyl)propanoylamino]thiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[3-(4-morpholinosulfonylphenyl)propanoylamino]thiophene-3-carboxylic acid methyl ester Formula: C21H26N2O6S2 MolecularWeight: 466.57094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C

InChI

InChI=1S/C21H26N2O6S2/c1-14-15(2)30-20(19(14)21(25)28-3)22-18(24)9-6-16-4-7-17(8-5-16)31(26,27)23-10-12-29-13-11-23/h4-5,7-8H,6,9-13H2,1-3H3,(H,22,24)