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

Systemtic Name: ethyl 4-(4-bromophenyl)-2-[3-(4-dimethylaminophenyl)prop-2-enoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-bromophenyl)-2-[3-(4-dimethylaminophenyl)prop-2-enoylamino]thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-2-[[3-(4-dimethylaminophenyl)-1-oxoprop-2-enyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-bromophenyl)-2-[3-(4-dimethylaminophenyl)prop-2-enoylamino]thiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-2-[[3-(4-dimethylaminophenyl)acryloyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C24H23BrN2O3S MolecularWeight: 499.42002

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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)N(C)C

Isomeric SMILES

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

InChI

InChI=1S/C24H23BrN2O3S/c1-4-30-24(29)22-20(17-8-10-18(25)11-9-17)15-31-23(22)26-21(28)14-7-16-5-12-19(13-6-16)27(2)3/h5-15H,4H2,1-3H3,(H,26,28)