N-(4-bromanyl-2-methyl-phenyl)-2-[2-(diphenylmethyl)sulfanylethanoyl-methyl-amino]ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[2-(diphenylmethyl)sulfanylethanoyl-methyl-amino]ethanamide Openeye Name: 2-[(2-benzhydrylsulfanylacetyl)-methyl-amino]-N-(4-bromo-2-methyl-phenyl)acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[[2-[(diphenylmethyl)thio]-1-oxoethyl]-methylamino]acetamide IUPAC Name: 2-[(2-benzhydrylsulfanylacetyl)-methylamino]-N-(4-bromo-2-methylphenyl)acetamide Traditional Name: 2-[[2-(benzhydrylthio)acetyl]-methyl-amino]-N-(4-bromo-2-methyl-phenyl)acetamide Formula: C25H25BrN2O2S MolecularWeight: 497.4472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)C(=O)CSC(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)C(=O)CSC(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H25BrN2O2S/c1-18-15-21(26)13-14-22(18)27-23(29)16-28(2)24(30)17-31-25(19-9-5-3-6-10-19)20-11-7-4-8-12-20/h3-15,25H,16-17H2,1-2H3,(H,27,29)