methyl 1-[2-[(4-methylphenyl)sulfonylamino]cyclohexyl]-1,2,3-triazole-4-carboxylate

Systemtic Name: methyl 1-[2-[(4-methylphenyl)sulfonylamino]cyclohexyl]-1,2,3-triazole-4-carboxylate Openeye Name: methyl 1-[2-(p-tolylsulfonylamino)cyclohexyl]triazole-4-carboxylate CAS Name: 1-[2-[(4-methylphenyl)sulfonylamino]cyclohexyl]-4-triazolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[(4-methylphenyl)sulfonylamino]cyclohexyl]triazole-4-carboxylate Traditional Name: 1-[2-(tosylamino)cyclohexyl]triazole-4-carboxylic acid methyl ester Formula: C17H22N4O4S MolecularWeight: 378.44598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2CCCCC2N3C=C(N=N3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2CCCCC2N3C=C(N=N3)C(=O)OC

InChI

InChI=1S/C17H22N4O4S/c1-12-7-9-13(10-8-12)26(23,24)19-14-5-3-4-6-16(14)21-11-15(18-20-21)17(22)25-2/h7-11,14,16,19H,3-6H2,1-2H3