4-[[(3,4-dimethylphenyl)-methylsulfonyl-amino]methyl]-N-(2-methylpropyl)benzamide

Systemtic Name: 4-[[(3,4-dimethylphenyl)-methylsulfonyl-amino]methyl]-N-(2-methylpropyl)benzamide Openeye Name: 4-[(3,4-dimethyl-N-methylsulfonyl-anilino)methyl]-N-isobutyl-benzamide CAS Name: 4-[(3,4-dimethyl-N-methylsulfonylanilino)methyl]-N-(2-methylpropyl)benzamide IUPAC Name: 4-[(3,4-dimethyl-N-methylsulfonylanilino)methyl]-N-(2-methylpropyl)benzamide Traditional Name: N-isobutyl-4-[(N-mesyl-3,4-dimethyl-anilino)methyl]benzamide Formula: C21H28N2O3S MolecularWeight: 388.52362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(CC2=CC=C(C=C2)C(=O)NCC(C)C)S(=O)(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N(CC2=CC=C(C=C2)C(=O)NCC(C)C)S(=O)(=O)C)C

InChI

InChI=1S/C21H28N2O3S/c1-15(2)13-22-21(24)19-9-7-18(8-10-19)14-23(27(5,25)26)20-11-6-16(3)17(4)12-20/h6-12,15H,13-14H2,1-5H3,(H,22,24)