4-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-methyl-N-[(4-methylphenyl)methyl]butanamide

Systemtic Name: 4-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-methyl-N-[(4-methylphenyl)methyl]butanamide Openeye Name: 4-(2,5-dimethyl-N-methylsulfonyl-anilino)-N-methyl-N-(p-tolylmethyl)butanamide CAS Name: 4-(2,5-dimethyl-N-methylsulfonylanilino)-N-methyl-N-[(4-methylphenyl)methyl]butanamide IUPAC Name: 4-(2,5-dimethyl-N-methylsulfonylanilino)-N-methyl-N-[(4-methylphenyl)methyl]butanamide Traditional Name: 4-(N-mesyl-2,5-dimethyl-anilino)-N-methyl-N-(4-methylbenzyl)butyramide Formula: C22H30N2O3S MolecularWeight: 402.5502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C)C(=O)CCCN(C2=C(C=CC(=C2)C)C)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CN(C)C(=O)CCCN(C2=C(C=CC(=C2)C)C)S(=O)(=O)C

InChI

InChI=1S/C22H30N2O3S/c1-17-9-12-20(13-10-17)16-23(4)22(25)7-6-14-24(28(5,26)27)21-15-18(2)8-11-19(21)3/h8-13,15H,6-7,14,16H2,1-5H3