ethyl 2-[3-(3-bromanyl-4-methoxy-phenyl)prop-2-enoylamino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[3-(3-bromanyl-4-methoxy-phenyl)prop-2-enoylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[3-(3-bromo-4-methoxy-phenyl)prop-2-enoylamino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[3-(3-bromo-4-methoxyphenyl)-1-oxoprop-2-enyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(3-bromo-4-methoxyphenyl)prop-2-enoylamino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[[3-(3-bromo-4-methoxy-phenyl)acryloyl]amino]-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C23H20BrNO4S MolecularWeight: 486.3782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20BrNO4S/c1-3-29-23(27)17-14-20(16-7-5-4-6-8-16)30-22(17)25-21(26)12-10-15-9-11-19(28-2)18(24)13-15/h4-14H,3H2,1-2H3,(H,25,26)