N-ethyl-3-[[(2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoyl]amino]benzamide

Systemtic Name: N-ethyl-3-[[(2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoyl]amino]benzamide Openeye Name: N-ethyl-3-[[(2S)-3-methyl-2-(p-tolylsulfonylamino)butanoyl]amino]benzamide CAS Name: N-ethyl-3-[[(2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]-1-oxobutyl]amino]benzamide IUPAC Name: N-ethyl-3-[[(2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoyl]amino]benzamide Traditional Name: N-ethyl-3-[[(2S)-3-methyl-2-(tosylamino)butanoyl]amino]benzamide Formula: C21H27N3O4S MolecularWeight: 417.52178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC(=CC=C1)NC(=O)C(C(C)C)NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCNC(=O)C1=CC(=CC=C1)NC(=O)[C@H](C(C)C)NS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C21H27N3O4S/c1-5-22-20(25)16-7-6-8-17(13-16)23-21(26)19(14(2)3)24-29(27,28)18-11-9-15(4)10-12-18/h6-14,19,24H,5H2,1-4H3,(H,22,25)(H,23,26)/t19-/m0/s1