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

Systemtic Name: 4-[[(3,4-dimethylphenyl)-methylsulfonyl-amino]methyl]-N-(3-methylbutyl)benzamide Openeye Name: 4-[(3,4-dimethyl-N-methylsulfonyl-anilino)methyl]-N-isopentyl-benzamide CAS Name: 4-[(3,4-dimethyl-N-methylsulfonylanilino)methyl]-N-(3-methylbutyl)benzamide IUPAC Name: 4-[(3,4-dimethyl-N-methylsulfonylanilino)methyl]-N-(3-methylbutyl)benzamide Traditional Name: N-isoamyl-4-[(N-mesyl-3,4-dimethyl-anilino)methyl]benzamide Formula: C22H30N2O3S MolecularWeight: 402.5502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30N2O3S/c1-16(2)12-13-23-22(25)20-9-7-19(8-10-20)15-24(28(5,26)27)21-11-6-17(3)18(4)14-21/h6-11,14,16H,12-13,15H2,1-5H3,(H,23,25)