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

Systemtic Name: 2-[3-methylbutyl-(4-nitrophenyl)sulfonyl-amino]-N-(4-methyl-1,3-thiazol-2-yl)ethanamide Openeye Name: 2-[isopentyl-(4-nitrophenyl)sulfonyl-amino]-N-(4-methylthiazol-2-yl)acetamide CAS Name: 2-[3-methylbutyl-(4-nitrophenyl)sulfonylamino]-N-(4-methyl-2-thiazolyl)acetamide IUPAC Name: 2-[3-methylbutyl-(4-nitrophenyl)sulfonylamino]-N-(4-methyl-1,3-thiazol-2-yl)acetamide Traditional Name: 2-[isoamyl(nosyl)amino]-N-(4-methylthiazol-2-yl)acetamide Formula: C17H22N4O5S2 MolecularWeight: 426.51038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NC(=O)CN(CCC(C)C)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CSC(=N1)NC(=O)CN(CCC(C)C)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H22N4O5S2/c1-12(2)8-9-20(10-16(22)19-17-18-13(3)11-27-17)28(25,26)15-6-4-14(5-7-15)21(23)24/h4-7,11-12H,8-10H2,1-3H3,(H,18,19,22)