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

Systemtic Name: 2-[3-methylbutyl-(phenylmethyl)sulfonyl-amino]-N-(4-methyl-1,3-thiazol-2-yl)ethanamide Openeye Name: 2-[benzylsulfonyl(isopentyl)amino]-N-(4-methylthiazol-2-yl)acetamide CAS Name: 2-[3-methylbutyl-(phenylmethyl)sulfonylamino]-N-(4-methyl-2-thiazolyl)acetamide IUPAC Name: 2-[benzylsulfonyl(3-methylbutyl)amino]-N-(4-methyl-1,3-thiazol-2-yl)acetamide Traditional Name: 2-[benzylsulfonyl(isoamyl)amino]-N-(4-methylthiazol-2-yl)acetamide Formula: C18H25N3O3S2 MolecularWeight: 395.5394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NC(=O)CN(CCC(C)C)S(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

CC1=CSC(=N1)NC(=O)CN(CCC(C)C)S(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C18H25N3O3S2/c1-14(2)9-10-21(11-17(22)20-18-19-15(3)12-25-18)26(23,24)13-16-7-5-4-6-8-16/h4-8,12,14H,9-11,13H2,1-3H3,(H,19,20,22)