methyl 2-[3-(2-bromanyl-4,5-dimethoxy-phenyl)propanoylamino]-4-(4-ethylphenyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-[3-(2-bromanyl-4,5-dimethoxy-phenyl)propanoylamino]-4-(4-ethylphenyl)thiophene-3-carboxylate Openeye Name: methyl 2-[3-(2-bromo-4,5-dimethoxy-phenyl)propanoylamino]-4-(4-ethylphenyl)thiophene-3-carboxylate CAS Name: 2-[[3-(2-bromo-4,5-dimethoxyphenyl)-1-oxopropyl]amino]-4-(4-ethylphenyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[3-(2-bromo-4,5-dimethoxyphenyl)propanoylamino]-4-(4-ethylphenyl)thiophene-3-carboxylate Traditional Name: 2-[3-(2-bromo-4,5-dimethoxy-phenyl)propanoylamino]-4-(4-ethylphenyl)thiophene-3-carboxylic acid methyl ester Formula: C25H26BrNO5S MolecularWeight: 532.44664

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)CCC3=CC(=C(C=C3Br)OC)OC

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)CCC3=CC(=C(C=C3Br)OC)OC

InChI

InChI=1S/C25H26BrNO5S/c1-5-15-6-8-16(9-7-15)18-14-33-24(23(18)25(29)32-4)27-22(28)11-10-17-12-20(30-2)21(31-3)13-19(17)26/h6-9,12-14H,5,10-11H2,1-4H3,(H,27,28)