2-bromanyl-N-[1-[3-[methyl(methylsulfonyl)amino]propylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 2-bromanyl-N-[1-[3-[methyl(methylsulfonyl)amino]propylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-bromo-N-[1-[3-[methyl(methylsulfonyl)amino]propylcarbamoyl]-3-methylsulfanyl-propyl]benzamide CAS Name: 2-bromo-N-[1-[3-[methyl(methylsulfonyl)amino]propylamino]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: 2-bromo-N-[1-[3-[methyl(methylsulfonyl)amino]propylamino]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: 2-bromo-N-[1-[3-[mesyl(methyl)amino]propylcarbamoyl]-3-(methylthio)propyl]benzamide Formula: C17H26BrN3O4S2 MolecularWeight: 480.44004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)C(CCSC)NC(=O)C1=CC=CC=C1Br)S(=O)(=O)C

Isomeric SMILES

CN(CCCNC(=O)C(CCSC)NC(=O)C1=CC=CC=C1Br)S(=O)(=O)C

InChI

InChI=1S/C17H26BrN3O4S2/c1-21(27(3,24)25)11-6-10-19-17(23)15(9-12-26-2)20-16(22)13-7-4-5-8-14(13)18/h4-5,7-8,15H,6,9-12H2,1-3H3,(H,19,23)(H,20,22)