N-(2,6-dimethylphenyl)-4-[4-(1,2,3,4-tetrazol-1-yl)phenyl]benzenesulfonamide

Systemtic Name: N-(2,6-dimethylphenyl)-4-[4-(1,2,3,4-tetrazol-1-yl)phenyl]benzenesulfonamide Openeye Name: N-(2,6-dimethylphenyl)-4-[4-(tetrazol-1-yl)phenyl]benzenesulfonamide CAS Name: N-(2,6-dimethylphenyl)-4-[4-(1-tetrazolyl)phenyl]benzenesulfonamide IUPAC Name: N-(2,6-dimethylphenyl)-4-[4-(tetrazol-1-yl)phenyl]benzenesulfonamide Traditional Name: N-(2,6-dimethylphenyl)-4-[4-(tetrazol-1-yl)phenyl]benzenesulfonamide Formula: C21H19N5O2S MolecularWeight: 405.47286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NS(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)N4C=NN=N4

Isomeric SMILES

CC1=C(C(=CC=C1)C)NS(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)N4C=NN=N4

InChI

InChI=1S/C21H19N5O2S/c1-15-4-3-5-16(2)21(15)23-29(27,28)20-12-8-18(9-13-20)17-6-10-19(11-7-17)26-14-22-24-25-26/h3-14,23H,1-2H3