N-[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]-2,1,3-benzoxadiazole-4-sulfonamide

Systemtic Name: N-[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]-2,1,3-benzoxadiazole-4-sulfonamide Openeye Name: N-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)-2,1,3-benzoxadiazole-4-sulfonamide CAS Name: N-[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]-2,1,3-benzoxadiazole-4-sulfonamide IUPAC Name: N-(1-benzyl-3,5-dimethylpyrazol-4-yl)-2,1,3-benzoxadiazole-4-sulfonamide Traditional Name: N-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)benzofurazan-4-sulfonamide Formula: C18H17N5O3S MolecularWeight: 383.42428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)NS(=O)(=O)C3=CC=CC4=NON=C43

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)NS(=O)(=O)C3=CC=CC4=NON=C43

InChI

InChI=1S/C18H17N5O3S/c1-12-17(13(2)23(19-12)11-14-7-4-3-5-8-14)22-27(24,25)16-10-6-9-15-18(16)21-26-20-15/h3-10,22H,11H2,1-2H3