2-[2-[(2-methylphenyl)-methylsulfonyl-amino]ethanoylamino]-N-[(1S)-1-phenylethyl]benzamide

Systemtic Name: 2-[2-[(2-methylphenyl)-methylsulfonyl-amino]ethanoylamino]-N-[(1S)-1-phenylethyl]benzamide Openeye Name: 2-[[2-(2-methyl-N-methylsulfonyl-anilino)acetyl]amino]-N-[(1S)-1-phenylethyl]benzamide CAS Name: 2-[[2-(2-methyl-N-methylsulfonylanilino)-1-oxoethyl]amino]-N-[(1S)-1-phenylethyl]benzamide IUPAC Name: 2-[[2-(2-methyl-N-methylsulfonylanilino)acetyl]amino]-N-[(1S)-1-phenylethyl]benzamide Traditional Name: 2-[[2-(N-mesyl-2-methyl-anilino)acetyl]amino]-N-[(1S)-1-phenylethyl]benzamide Formula: C25H27N3O4S MolecularWeight: 465.56458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(CC(=O)NC2=CC=CC=C2C(=O)NC(C)C3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=CC=C1N(CC(=O)NC2=CC=CC=C2C(=O)N[C@@H](C)C3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C25H27N3O4S/c1-18-11-7-10-16-23(18)28(33(3,31)32)17-24(29)27-22-15-9-8-14-21(22)25(30)26-19(2)20-12-5-4-6-13-20/h4-16,19H,17H2,1-3H3,(H,26,30)(H,27,29)/t19-/m0/s1