2-[(4-aminophenyl)methyl]-2-methyl-N,N'-bis[(2-sulfanylphenyl)methyl]propanediamide

Systemtic Name: 2-[(4-aminophenyl)methyl]-2-methyl-N,N'-bis[(2-sulfanylphenyl)methyl]propanediamide Openeye Name: 2-[(4-aminophenyl)methyl]-2-methyl-N,N'-bis[(2-sulfanylphenyl)methyl]propanediamide CAS Name: 2-[(4-aminophenyl)methyl]-N,N'-bis[(2-mercaptophenyl)methyl]-2-methylpropanediamide IUPAC Name: 2-[(4-aminophenyl)methyl]-2-methyl-N,N'-bis[(2-sulfanylphenyl)methyl]propanediamide Traditional Name: 2-(4-aminobenzyl)-N,N'-bis(2-mercaptobenzyl)-2-methyl-malonamide Formula: C25H27N3O2S2 MolecularWeight: 465.63078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)N)(C(=O)NCC2=CC=CC=C2S)C(=O)NCC3=CC=CC=C3S

Isomeric SMILES

CC(CC1=CC=C(C=C1)N)(C(=O)NCC2=CC=CC=C2S)C(=O)NCC3=CC=CC=C3S

InChI

InChI=1S/C25H27N3O2S2/c1-25(14-17-10-12-20(26)13-11-17,23(29)27-15-18-6-2-4-8-21(18)31)24(30)28-16-19-7-3-5-9-22(19)32/h2-13,31-32H,14-16,26H2,1H3,(H,27,29)(H,28,30)