methyl 2-[[(E)-3-(4-bromophenyl)prop-2-enoyl]amino]-4-ethyl-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[[(E)-3-(4-bromophenyl)prop-2-enoyl]amino]-4-ethyl-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[(E)-3-(4-bromophenyl)prop-2-enoyl]amino]-4-ethyl-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[(E)-3-(4-bromophenyl)-1-oxoprop-2-enyl]amino]-4-ethyl-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(E)-3-(4-bromophenyl)prop-2-enoyl]amino]-4-ethyl-5-methylthiophene-3-carboxylate Traditional Name: 2-[[(E)-3-(4-bromophenyl)acryloyl]amino]-4-ethyl-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C18H18BrNO3S MolecularWeight: 408.30942

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OC)NC(=O)C=CC2=CC=C(C=C2)Br)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OC)NC(=O)/C=C/C2=CC=C(C=C2)Br)C

InChI

InChI=1S/C18H18BrNO3S/c1-4-14-11(2)24-17(16(14)18(22)23-3)20-15(21)10-7-12-5-8-13(19)9-6-12/h5-10H,4H2,1-3H3,(H,20,21)/b10-7+