2-[3-methylbutyl-(2,4,6-trimethylphenyl)sulfonyl-amino]-N-(4-methyl-1,3-thiazol-2-yl)ethanamide

Systemtic Name: 2-[3-methylbutyl-(2,4,6-trimethylphenyl)sulfonyl-amino]-N-(4-methyl-1,3-thiazol-2-yl)ethanamide Openeye Name: 2-[isopentyl-(2,4,6-trimethylphenyl)sulfonyl-amino]-N-(4-methylthiazol-2-yl)acetamide CAS Name: 2-[3-methylbutyl-(2,4,6-trimethylphenyl)sulfonylamino]-N-(4-methyl-2-thiazolyl)acetamide IUPAC Name: 2-[3-methylbutyl-(2,4,6-trimethylphenyl)sulfonylamino]-N-(4-methyl-1,3-thiazol-2-yl)acetamide Traditional Name: 2-[isoamyl(mesitylsulfonyl)amino]-N-(4-methylthiazol-2-yl)acetamide Formula: C20H29N3O3S2 MolecularWeight: 423.59256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N(CCC(C)C)CC(=O)NC2=NC(=CS2)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N(CCC(C)C)CC(=O)NC2=NC(=CS2)C)C

InChI

InChI=1S/C20H29N3O3S2/c1-13(2)7-8-23(11-18(24)22-20-21-17(6)12-27-20)28(25,26)19-15(4)9-14(3)10-16(19)5/h9-10,12-13H,7-8,11H2,1-6H3,(H,21,22,24)