ethyl 4-(4-bromophenyl)-2-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-bromophenyl)-2-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-bromophenyl)-2-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-2-[[3-(3,4-dimethoxyphenyl)-1-oxoprop-2-enyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-bromophenyl)-2-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]thiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-2-[[3-(3,4-dimethoxyphenyl)acryloyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C24H22BrNO5S MolecularWeight: 516.40418

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=O)C=CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=O)C=CC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C24H22BrNO5S/c1-4-31-24(28)22-18(16-7-9-17(25)10-8-16)14-32-23(22)26-21(27)12-6-15-5-11-19(29-2)20(13-15)30-3/h5-14H,4H2,1-3H3,(H,26,27)