ethyl 2-[[(E)-3-(5-bromanyl-2-methoxy-phenyl)prop-2-enoyl]amino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[(E)-3-(5-bromanyl-2-methoxy-phenyl)prop-2-enoyl]amino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[(E)-3-(5-bromo-2-methoxy-phenyl)prop-2-enoyl]amino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate CAS Name: 2-[[(E)-3-(5-bromo-2-methoxyphenyl)-1-oxoprop-2-enyl]amino]-4-(4-ethoxyphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(E)-3-(5-bromo-2-methoxyphenyl)prop-2-enoyl]amino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate Traditional Name: 2-[[(E)-3-(5-bromo-2-methoxy-phenyl)acryloyl]amino]-4-p-phenetyl-thiophene-3-carboxylic acid ethyl ester Formula: C25H24BrNO5S MolecularWeight: 530.43076

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CSC(=C2C(=O)OCC)NC(=O)C=CC3=C(C=CC(=C3)Br)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CSC(=C2C(=O)OCC)NC(=O)/C=C/C3=C(C=CC(=C3)Br)OC

InChI

InChI=1S/C25H24BrNO5S/c1-4-31-19-10-6-16(7-11-19)20-15-33-24(23(20)25(29)32-5-2)27-22(28)13-8-17-14-18(26)9-12-21(17)30-3/h6-15H,4-5H2,1-3H3,(H,27,28)/b13-8+