methyl 2-[methyl-(4-methylphenyl)sulfonyl-amino]ethanoate; 1H-1,2,4-triazole

Systemtic Name: methyl 2-[methyl-(4-methylphenyl)sulfonyl-amino]ethanoate; 1H-1,2,4-triazole Openeye Name: methyl 2-[methyl(p-tolylsulfonyl)amino]acetate; 1H-1,2,4-triazole CAS Name: 2-[methyl-(4-methylphenyl)sulfonylamino]acetic acid methyl ester; 1H-1,2,4-triazole IUPAC Name: methyl 2-[methyl-(4-methylphenyl)sulfonylamino]acetate; 1H-1,2,4-triazole Traditional Name: 2-[methyl(tosyl)amino]acetic acid methyl ester; 1H-1,2,4-triazole Formula: C13H18N4O4S MolecularWeight: 326.37142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)OC.C1=NC=NN1

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)OC.C1=NC=NN1

InChI

InChI=1S/C11H15NO4S.C2H3N3/c1-9-4-6-10(7-5-9)17(14,15)12(2)8-11(13)16-3;1-3-2-5-4-1/h4-7H,8H2,1-3H3;1-2H,(H,3,4,5)