2-[[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]-N-(2-prop-2-enylsulfanylphenyl)ethanamide

Systemtic Name: 2-[[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]-N-(2-prop-2-enylsulfanylphenyl)ethanamide Openeye Name: N-(2-allylsulfanylphenyl)-2-[[2-(2-bromoanilino)-2-oxo-ethyl]-methyl-amino]acetamide CAS Name: 2-[[2-(2-bromoanilino)-2-oxoethyl]-methylamino]-N-[2-(prop-2-enylthio)phenyl]acetamide IUPAC Name: 2-[[2-(2-bromoanilino)-2-oxoethyl]-methylamino]-N-(2-prop-2-enylsulfanylphenyl)acetamide Traditional Name: N-[2-(allylthio)phenyl]-2-[[2-(2-bromoanilino)-2-keto-ethyl]-methyl-amino]acetamide Formula: C20H22BrN3O2S MolecularWeight: 448.37658

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=CC=C1SCC=C)CC(=O)NC2=CC=CC=C2Br

Isomeric SMILES

CN(CC(=O)NC1=CC=CC=C1SCC=C)CC(=O)NC2=CC=CC=C2Br

InChI

InChI=1S/C20H22BrN3O2S/c1-3-12-27-18-11-7-6-10-17(18)23-20(26)14-24(2)13-19(25)22-16-9-5-4-8-15(16)21/h3-11H,1,12-14H2,2H3,(H,22,25)(H,23,26)