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

Systemtic Name: 2-[2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]ethanoylamino]-N-propan-2-yl-benzamide Openeye Name: 2-[[2-(3,5-dimethyl-N-methylsulfonyl-anilino)acetyl]amino]-N-isopropyl-benzamide CAS Name: 2-[[2-(3,5-dimethyl-N-methylsulfonylanilino)-1-oxoethyl]amino]-N-propan-2-ylbenzamide IUPAC Name: 2-[[2-(3,5-dimethyl-N-methylsulfonylanilino)acetyl]amino]-N-propan-2-ylbenzamide Traditional Name: N-isopropyl-2-[[2-(N-mesyl-3,5-dimethyl-anilino)acetyl]amino]benzamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O4S/c1-14(2)22-21(26)18-8-6-7-9-19(18)23-20(25)13-24(29(5,27)28)17-11-15(3)10-16(4)12-17/h6-12,14H,13H2,1-5H3,(H,22,26)(H,23,25)