4-[[(3,4-dimethylphenyl)-methylsulfonyl-amino]methyl]-N-[(2S)-1-methoxypropan-2-yl]benzamide

Systemtic Name: 4-[[(3,4-dimethylphenyl)-methylsulfonyl-amino]methyl]-N-[(2S)-1-methoxypropan-2-yl]benzamide Openeye Name: 4-[(3,4-dimethyl-N-methylsulfonyl-anilino)methyl]-N-[(1S)-2-methoxy-1-methyl-ethyl]benzamide CAS Name: 4-[(3,4-dimethyl-N-methylsulfonylanilino)methyl]-N-[(2S)-1-methoxypropan-2-yl]benzamide IUPAC Name: 4-[(3,4-dimethyl-N-methylsulfonylanilino)methyl]-N-[(2S)-1-methoxypropan-2-yl]benzamide Traditional Name: 4-[(N-mesyl-3,4-dimethyl-anilino)methyl]-N-[(1S)-2-methoxy-1-methyl-ethyl]benzamide Formula: C21H28N2O4S MolecularWeight: 404.52302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(CC2=CC=C(C=C2)C(=O)NC(C)COC)S(=O)(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N(CC2=CC=C(C=C2)C(=O)N[C@@H](C)COC)S(=O)(=O)C)C

InChI

InChI=1S/C21H28N2O4S/c1-15-6-11-20(12-16(15)2)23(28(5,25)26)13-18-7-9-19(10-8-18)21(24)22-17(3)14-27-4/h6-12,17H,13-14H2,1-5H3,(H,22,24)/t17-/m0/s1