N-[2-(4-bromophenyl)sulfanylethyl]-2-[[2-(tert-butylamino)-2-oxidanylidene-ethyl]-methyl-amino]ethanamide

Systemtic Name: N-[2-(4-bromophenyl)sulfanylethyl]-2-[[2-(tert-butylamino)-2-oxidanylidene-ethyl]-methyl-amino]ethanamide Openeye Name: N-[2-(4-bromophenyl)sulfanylethyl]-2-[[2-(tert-butylamino)-2-oxo-ethyl]-methyl-amino]acetamide CAS Name: N-[2-[(4-bromophenyl)thio]ethyl]-2-[[2-(tert-butylamino)-2-oxoethyl]-methylamino]acetamide IUPAC Name: N-[2-(4-bromophenyl)sulfanylethyl]-2-[[2-(tert-butylamino)-2-oxoethyl]-methylamino]acetamide Traditional Name: N-[2-[(4-bromophenyl)thio]ethyl]-2-[[2-(tert-butylamino)-2-keto-ethyl]-methyl-amino]acetamide Formula: C17H26BrN3O2S MolecularWeight: 416.37624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN(C)CC(=O)NCCSC1=CC=C(C=C1)Br

Isomeric SMILES

CC(C)(C)NC(=O)CN(C)CC(=O)NCCSC1=CC=C(C=C1)Br

InChI

InChI=1S/C17H26BrN3O2S/c1-17(2,3)20-16(23)12-21(4)11-15(22)19-9-10-24-14-7-5-13(18)6-8-14/h5-8H,9-12H2,1-4H3,(H,19,22)(H,20,23)