2-[3-methylbutyl(naphthalen-1-ylsulfonyl)amino]-N-(4-methyl-1,3-thiazol-2-yl)ethanamide

Systemtic Name: 2-[3-methylbutyl(naphthalen-1-ylsulfonyl)amino]-N-(4-methyl-1,3-thiazol-2-yl)ethanamide Openeye Name: 2-[isopentyl(1-naphthylsulfonyl)amino]-N-(4-methylthiazol-2-yl)acetamide CAS Name: 2-[3-methylbutyl(1-naphthalenylsulfonyl)amino]-N-(4-methyl-2-thiazolyl)acetamide IUPAC Name: 2-[3-methylbutyl(naphthalen-1-ylsulfonyl)amino]-N-(4-methyl-1,3-thiazol-2-yl)acetamide Traditional Name: 2-[isoamyl(1-naphthylsulfonyl)amino]-N-(4-methylthiazol-2-yl)acetamide Formula: C21H25N3O3S2 MolecularWeight: 431.5715

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NC(=O)CN(CCC(C)C)S(=O)(=O)C2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC1=CSC(=N1)NC(=O)CN(CCC(C)C)S(=O)(=O)C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C21H25N3O3S2/c1-15(2)11-12-24(13-20(25)23-21-22-16(3)14-28-21)29(26,27)19-10-6-8-17-7-4-5-9-18(17)19/h4-10,14-15H,11-13H2,1-3H3,(H,22,23,25)