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

Systemtic Name: propan-2-yl 2-[[(E)-3-(4-bromophenyl)prop-2-enoyl]amino]-4-ethyl-5-methyl-thiophene-3-carboxylate Openeye Name: isopropyl 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 propan-2-yl ester IUPAC Name: propan-2-yl 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 isopropyl ester Formula: C20H22BrNO3S MolecularWeight: 436.36258

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22BrNO3S/c1-5-16-13(4)26-19(18(16)20(24)25-12(2)3)22-17(23)11-8-14-6-9-15(21)10-7-14/h6-12H,5H2,1-4H3,(H,22,23)/b11-8+