2-[2-[methyl-(4-methylphenyl)sulfonyl-amino]ethanoylamino]-N-[(1S)-1-phenylethyl]benzamide

Systemtic Name: 2-[2-[methyl-(4-methylphenyl)sulfonyl-amino]ethanoylamino]-N-[(1S)-1-phenylethyl]benzamide Openeye Name: 2-[[2-[methyl(p-tolylsulfonyl)amino]acetyl]amino]-N-[(1S)-1-phenylethyl]benzamide CAS Name: 2-[[2-[methyl-(4-methylphenyl)sulfonylamino]-1-oxoethyl]amino]-N-[(1S)-1-phenylethyl]benzamide IUPAC Name: 2-[[2-[methyl-(4-methylphenyl)sulfonylamino]acetyl]amino]-N-[(1S)-1-phenylethyl]benzamide Traditional Name: 2-[[2-[methyl(tosyl)amino]acetyl]amino]-N-[(1S)-1-phenylethyl]benzamide Formula: C25H27N3O4S MolecularWeight: 465.56458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NC2=CC=CC=C2C(=O)NC(C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NC2=CC=CC=C2C(=O)N[C@@H](C)C3=CC=CC=C3

InChI

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