(2R)-2-[[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]amino]-N-(4-bromophenyl)propanamide

Systemtic Name: (2R)-2-[[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]amino]-N-(4-bromophenyl)propanamide Openeye Name: (2R)-2-[2-(2-amino-2-oxo-ethyl)sulfanylanilino]-N-(4-bromophenyl)propanamide CAS Name: (2R)-2-[2-[(2-amino-2-oxoethyl)thio]anilino]-N-(4-bromophenyl)propanamide IUPAC Name: (2R)-2-[2-(2-amino-2-oxoethyl)sulfanylanilino]-N-(4-bromophenyl)propanamide Traditional Name: (2R)-2-[2-[(2-amino-2-keto-ethyl)thio]anilino]-N-(4-bromophenyl)propionamide Formula: C17H18BrN3O2S MolecularWeight: 408.31272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)Br)NC2=CC=CC=C2SCC(=O)N

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)Br)NC2=CC=CC=C2SCC(=O)N

InChI

InChI=1S/C17H18BrN3O2S/c1-11(17(23)21-13-8-6-12(18)7-9-13)20-14-4-2-3-5-15(14)24-10-16(19)22/h2-9,11,20H,10H2,1H3,(H2,19,22)(H,21,23)/t11-/m1/s1