N-(2,6-diethylphenyl)-4-[(3-methylphenyl)-methylsulfonyl-amino]butanamide

Systemtic Name: N-(2,6-diethylphenyl)-4-[(3-methylphenyl)-methylsulfonyl-amino]butanamide Openeye Name: N-(2,6-diethylphenyl)-4-(3-methyl-N-methylsulfonyl-anilino)butanamide CAS Name: N-(2,6-diethylphenyl)-4-(3-methyl-N-methylsulfonylanilino)butanamide IUPAC Name: N-(2,6-diethylphenyl)-4-(3-methyl-N-methylsulfonylanilino)butanamide Traditional Name: N-(2,6-diethylphenyl)-4-(N-mesyl-3-methyl-anilino)butyramide Formula: C22H30N2O3S MolecularWeight: 402.5502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)CCCN(C2=CC=CC(=C2)C)S(=O)(=O)C

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)CCCN(C2=CC=CC(=C2)C)S(=O)(=O)C

InChI

InChI=1S/C22H30N2O3S/c1-5-18-11-8-12-19(6-2)22(18)23-21(25)14-9-15-24(28(4,26)27)20-13-7-10-17(3)16-20/h7-8,10-13,16H,5-6,9,14-15H2,1-4H3,(H,23,25)