N-(4-bromanyl-2-methyl-phenyl)-2-[2-[(4-cyanophenyl)methylsulfanyl]ethanoylamino]ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[2-[(4-cyanophenyl)methylsulfanyl]ethanoylamino]ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[[2-[(4-cyanophenyl)methylsulfanyl]acetyl]amino]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[[2-[(4-cyanophenyl)methylthio]-1-oxoethyl]amino]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[[2-[(4-cyanophenyl)methylsulfanyl]acetyl]amino]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[[2-[(4-cyanobenzyl)thio]acetyl]amino]acetamide Formula: C19H18BrN3O2S MolecularWeight: 432.33412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)CSCC2=CC=C(C=C2)C#N

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)CSCC2=CC=C(C=C2)C#N

InChI

InChI=1S/C19H18BrN3O2S/c1-13-8-16(20)6-7-17(13)23-18(24)10-22-19(25)12-26-11-15-4-2-14(9-21)3-5-15/h2-8H,10-12H2,1H3,(H,22,25)(H,23,24)