5-[(4-methylphenyl)sulfonylamino]-2H-1,2,3-triazole-4-carboxamide hydrate

Systemtic Name: 5-[(4-methylphenyl)sulfonylamino]-2H-1,2,3-triazole-4-carboxamide hydrate Openeye Name: 5-(p-tolylsulfonylamino)-2H-triazole-4-carboxamide hydrate CAS Name: 5-[(4-methylphenyl)sulfonylamino]-2H-triazole-4-carboxamide hydrate IUPAC Name: 5-[(4-methylphenyl)sulfonylamino]-2H-triazole-4-carboxamide hydrate Traditional Name: 5-(tosylamino)-2H-triazole-4-carboxamide hydrate Formula: C10H13N5O4S MolecularWeight: 299.30632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=NNN=C2C(=O)N.O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=NNN=C2C(=O)N.O

InChI

InChI=1S/C10H11N5O3S.H2O/c1-6-2-4-7(5-3-6)19(17,18)14-10-8(9(11)16)12-15-13-10;/h2-5H,1H3,(H2,11,16)(H2,12,13,14,15);1H2