2-[(3,4-dimethylphenyl)-methylsulfonyl-amino]-N-[2-(4-methoxyphenyl)ethyl]butanamide

Systemtic Name: 2-[(3,4-dimethylphenyl)-methylsulfonyl-amino]-N-[2-(4-methoxyphenyl)ethyl]butanamide Openeye Name: 2-(3,4-dimethyl-N-methylsulfonyl-anilino)-N-[2-(4-methoxyphenyl)ethyl]butanamide CAS Name: 2-(3,4-dimethyl-N-methylsulfonylanilino)-N-[2-(4-methoxyphenyl)ethyl]butanamide IUPAC Name: 2-(3,4-dimethyl-N-methylsulfonylanilino)-N-[2-(4-methoxyphenyl)ethyl]butanamide Traditional Name: 2-(N-mesyl-3,4-dimethyl-anilino)-N-[2-(4-methoxyphenyl)ethyl]butyramide Formula: C22H30N2O4S MolecularWeight: 418.5496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCCC1=CC=C(C=C1)OC)N(C2=CC(=C(C=C2)C)C)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NCCC1=CC=C(C=C1)OC)N(C2=CC(=C(C=C2)C)C)S(=O)(=O)C

InChI

InChI=1S/C22H30N2O4S/c1-6-21(22(25)23-14-13-18-8-11-20(28-4)12-9-18)24(29(5,26)27)19-10-7-16(2)17(3)15-19/h7-12,15,21H,6,13-14H2,1-5H3,(H,23,25)