[2-[2-(4-bromophenyl)sulfanylethylamino]-2-oxidanylidene-ethyl] (E)-but-2-enoate

Systemtic Name: [2-[2-(4-bromophenyl)sulfanylethylamino]-2-oxidanylidene-ethyl] (E)-but-2-enoate Openeye Name: [2-[2-(4-bromophenyl)sulfanylethylamino]-2-oxo-ethyl] (E)-but-2-enoate CAS Name: (E)-2-butenoic acid [2-[2-[(4-bromophenyl)thio]ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-bromophenyl)sulfanylethylamino]-2-oxoethyl] (E)-but-2-enoate Traditional Name: (E)-but-2-enoic acid [2-[2-[(4-bromophenyl)thio]ethylamino]-2-keto-ethyl] ester Formula: C14H16BrNO3S MolecularWeight: 358.25074

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)OCC(=O)NCCSC1=CC=C(C=C1)Br

Isomeric SMILES

C/C=C/C(=O)OCC(=O)NCCSC1=CC=C(C=C1)Br

InChI

InChI=1S/C14H16BrNO3S/c1-2-3-14(18)19-10-13(17)16-8-9-20-12-6-4-11(15)5-7-12/h2-7H,8-10H2,1H3,(H,16,17)/b3-2+