2-[2-[methylsulfonyl(phenyl)amino]butanoylamino]-N-(phenylmethyl)benzamide

Systemtic Name: 2-[2-[methylsulfonyl(phenyl)amino]butanoylamino]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-2-[2-(N-methylsulfonylanilino)butanoylamino]benzamide CAS Name: 2-[[2-(N-methylsulfonylanilino)-1-oxobutyl]amino]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-2-[2-(N-methylsulfonylanilino)butanoylamino]benzamide Traditional Name: N-benzyl-2-[2-(N-mesylanilino)butanoylamino]benzamide Formula: C25H27N3O4S MolecularWeight: 465.56458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1C(=O)NCC2=CC=CC=C2)N(C3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1C(=O)NCC2=CC=CC=C2)N(C3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C25H27N3O4S/c1-3-23(28(33(2,31)32)20-14-8-5-9-15-20)25(30)27-22-17-11-10-16-21(22)24(29)26-18-19-12-6-4-7-13-19/h4-17,23H,3,18H2,1-2H3,(H,26,29)(H,27,30)