2-chloranyl-N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-5-methylsulfonyl-aniline

Systemtic Name: 2-chloranyl-N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-5-methylsulfonyl-aniline Openeye Name: 2-chloro-N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-5-methylsulfonyl-aniline CAS Name: 2-chloro-N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-5-methylsulfonylaniline IUPAC Name: 2-chloro-N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-5-methylsulfonylaniline Traditional Name: (2-chloro-5-mesyl-phenyl)-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]amine Formula: C13H16ClN3O2S MolecularWeight: 313.80304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)CNC2=C(C=CC(=C2)S(=O)(=O)C)Cl

Isomeric SMILES

CC1=C(C(=NN1)C)CNC2=C(C=CC(=C2)S(=O)(=O)C)Cl

InChI

InChI=1S/C13H16ClN3O2S/c1-8-11(9(2)17-16-8)7-15-13-6-10(20(3,18)19)4-5-12(13)14/h4-6,15H,7H2,1-3H3,(H,16,17)