4-ethoxy-N-[(2S)-3-methyl-1-[(3-methylsulfonylphenyl)amino]-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 4-ethoxy-N-[(2S)-3-methyl-1-[(3-methylsulfonylphenyl)amino]-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 4-ethoxy-N-[(1S)-2-methyl-1-[(3-methylsulfonylphenyl)carbamoyl]propyl]benzamide CAS Name: 4-ethoxy-N-[(2S)-3-methyl-1-(3-methylsulfonylanilino)-1-oxobutan-2-yl]benzamide IUPAC Name: 4-ethoxy-N-[(2S)-3-methyl-1-(3-methylsulfonylanilino)-1-oxobutan-2-yl]benzamide Traditional Name: 4-ethoxy-N-[(1S)-1-[(3-mesylphenyl)carbamoyl]-2-methyl-propyl]benzamide Formula: C21H26N2O5S MolecularWeight: 418.50654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NC(C(C)C)C(=O)NC2=CC(=CC=C2)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)N[C@@H](C(C)C)C(=O)NC2=CC(=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C21H26N2O5S/c1-5-28-17-11-9-15(10-12-17)20(24)23-19(14(2)3)21(25)22-16-7-6-8-18(13-16)29(4,26)27/h6-14,19H,5H2,1-4H3,(H,22,25)(H,23,24)/t19-/m0/s1