ethyl 5-(3,4-dimethoxyphenyl)-3-[3-[(2-methylphenyl)carbonylamino]propanoylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 5-(3,4-dimethoxyphenyl)-3-[3-[(2-methylphenyl)carbonylamino]propanoylamino]thiophene-2-carboxylate Openeye Name: ethyl 5-(3,4-dimethoxyphenyl)-3-[3-[(2-methylbenzoyl)amino]propanoylamino]thiophene-2-carboxylate CAS Name: 5-(3,4-dimethoxyphenyl)-3-[[3-[[(2-methylphenyl)-oxomethyl]amino]-1-oxopropyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(3,4-dimethoxyphenyl)-3-[3-[(2-methylbenzoyl)amino]propanoylamino]thiophene-2-carboxylate Traditional Name: 5-(3,4-dimethoxyphenyl)-3-[3-(o-toluoylamino)propanoylamino]thiophene-2-carboxylic acid ethyl ester Formula: C26H28N2O6S MolecularWeight: 496.57532

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC(=C(C=C2)OC)OC)NC(=O)CCNC(=O)C3=CC=CC=C3C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC(=C(C=C2)OC)OC)NC(=O)CCNC(=O)C3=CC=CC=C3C

InChI

InChI=1S/C26H28N2O6S/c1-5-34-26(31)24-19(15-22(35-24)17-10-11-20(32-3)21(14-17)33-4)28-23(29)12-13-27-25(30)18-9-7-6-8-16(18)2/h6-11,14-15H,5,12-13H2,1-4H3,(H,27,30)(H,28,29)