2-[2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]ethanoylamino]-N-(2-methylpropyl)benzamide

Systemtic Name: 2-[2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]ethanoylamino]-N-(2-methylpropyl)benzamide Openeye Name: 2-[[2-(3,5-dimethyl-N-methylsulfonyl-anilino)acetyl]amino]-N-isobutyl-benzamide CAS Name: 2-[[2-(3,5-dimethyl-N-methylsulfonylanilino)-1-oxoethyl]amino]-N-(2-methylpropyl)benzamide IUPAC Name: 2-[[2-(3,5-dimethyl-N-methylsulfonylanilino)acetyl]amino]-N-(2-methylpropyl)benzamide Traditional Name: N-isobutyl-2-[[2-(N-mesyl-3,5-dimethyl-anilino)acetyl]amino]benzamide Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O4S/c1-15(2)13-23-22(27)19-8-6-7-9-20(19)24-21(26)14-25(30(5,28)29)18-11-16(3)10-17(4)12-18/h6-12,15H,13-14H2,1-5H3,(H,23,27)(H,24,26)