2-[2-[(2,5-dimethylphenyl)-methylsulfonyl-amino]ethanoylamino]-N-(phenylmethyl)benzamide

Systemtic Name: 2-[2-[(2,5-dimethylphenyl)-methylsulfonyl-amino]ethanoylamino]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-2-[[2-(2,5-dimethyl-N-methylsulfonyl-anilino)acetyl]amino]benzamide CAS Name: 2-[[2-(2,5-dimethyl-N-methylsulfonylanilino)-1-oxoethyl]amino]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-2-[[2-(2,5-dimethyl-N-methylsulfonylanilino)acetyl]amino]benzamide Traditional Name: N-benzyl-2-[[2-(N-mesyl-2,5-dimethyl-anilino)acetyl]amino]benzamide Formula: C25H27N3O4S MolecularWeight: 465.56458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N(CC(=O)NC2=CC=CC=C2C(=O)NCC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)N(CC(=O)NC2=CC=CC=C2C(=O)NCC3=CC=CC=C3)S(=O)(=O)C

InChI

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