5-chloranyl-N-(cyanomethyl)-1,3-dimethyl-N-(phenylmethyl)pyrazole-4-sulfonamide

Systemtic Name: 5-chloranyl-N-(cyanomethyl)-1,3-dimethyl-N-(phenylmethyl)pyrazole-4-sulfonamide Openeye Name: N-benzyl-5-chloro-N-(cyanomethyl)-1,3-dimethyl-pyrazole-4-sulfonamide CAS Name: 5-chloro-N-(cyanomethyl)-1,3-dimethyl-N-(phenylmethyl)-4-pyrazolesulfonamide IUPAC Name: N-benzyl-5-chloro-N-(cyanomethyl)-1,3-dimethylpyrazole-4-sulfonamide Traditional Name: N-benzyl-5-chloro-N-(cyanomethyl)-1,3-dimethyl-pyrazole-4-sulfonamide Formula: C14H15ClN4O2S MolecularWeight: 338.8125

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1S(=O)(=O)N(CC#N)CC2=CC=CC=C2)Cl)C

Isomeric SMILES

CC1=NN(C(=C1S(=O)(=O)N(CC#N)CC2=CC=CC=C2)Cl)C

InChI

InChI=1S/C14H15ClN4O2S/c1-11-13(14(15)18(2)17-11)22(20,21)19(9-8-16)10-12-6-4-3-5-7-12/h3-7H,9-10H2,1-2H3