[2-[1-(4-bromophenyl)ethylamino]-2-oxidanylidene-ethyl] (E)-3-thiophen-2-ylprop-2-enoate

Systemtic Name: [2-[1-(4-bromophenyl)ethylamino]-2-oxidanylidene-ethyl] (E)-3-thiophen-2-ylprop-2-enoate Openeye Name: [2-[1-(4-bromophenyl)ethylamino]-2-oxo-ethyl] (E)-3-(2-thienyl)prop-2-enoate CAS Name: (E)-3-thiophen-2-yl-2-propenoic acid [2-[1-(4-bromophenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[1-(4-bromophenyl)ethylamino]-2-oxoethyl] (E)-3-thiophen-2-ylprop-2-enoate Traditional Name: (E)-3-(2-thienyl)acrylic acid [2-[1-(4-bromophenyl)ethylamino]-2-keto-ethyl] ester Formula: C17H16BrNO3S MolecularWeight: 394.28284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)Br)NC(=O)COC(=O)C=CC2=CC=CS2

Isomeric SMILES

CC(C1=CC=C(C=C1)Br)NC(=O)COC(=O)/C=C/C2=CC=CS2

InChI

InChI=1S/C17H16BrNO3S/c1-12(13-4-6-14(18)7-5-13)19-16(20)11-22-17(21)9-8-15-3-2-10-23-15/h2-10,12H,11H2,1H3,(H,19,20)/b9-8+