2-(3-chlorophenyl)-3-methyl-3,4-dihydropyrazol-5-amine; 4-methylbenzenesulfonic acid

Systemtic Name: 2-(3-chlorophenyl)-3-methyl-3,4-dihydropyrazol-5-amine; 4-methylbenzenesulfonic acid Openeye Name: 2-(3-chlorophenyl)-3-methyl-3,4-dihydropyrazol-5-amine; 4-methylbenzenesulfonic acid CAS Name: 2-(3-chlorophenyl)-3-methyl-3,4-dihydropyrazol-5-amine; 4-methylbenzenesulfonic acid IUPAC Name: 2-(3-chlorophenyl)-3-methyl-3,4-dihydropyrazol-5-amine; 4-methylbenzenesulfonic acid Traditional Name: [1-(3-chlorophenyl)-5-methyl-2-pyrazolin-3-yl]amine; tosylic acid Formula: C17H20ClN3O3S MolecularWeight: 381.877

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=NN1C2=CC(=CC=C2)Cl)N.CC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CC1CC(=NN1C2=CC(=CC=C2)Cl)N.CC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C10H12ClN3.C7H8O3S/c1-7-5-10(12)13-14(7)9-4-2-3-8(11)6-9;1-6-2-4-7(5-3-6)11(8,9)10/h2-4,6-7H,5H2,1H3,(H2,12,13);2-5H,1H3,(H,8,9,10)