4-[4-(3,4-dimethylphenyl)sulfonyl-5-phenyl-1,2,3-triazol-1-yl]aniline

Systemtic Name: 4-[4-(3,4-dimethylphenyl)sulfonyl-5-phenyl-1,2,3-triazol-1-yl]aniline Openeye Name: 4-[4-(3,4-dimethylphenyl)sulfonyl-5-phenyl-triazol-1-yl]aniline CAS Name: 4-[4-(3,4-dimethylphenyl)sulfonyl-5-phenyl-1-triazolyl]aniline IUPAC Name: 4-[4-(3,4-dimethylphenyl)sulfonyl-5-phenyltriazol-1-yl]aniline Traditional Name: [4-[4-(3,4-dimethylphenyl)sulfonyl-5-phenyl-triazol-1-yl]phenyl]amine Formula: C22H20N4O2S MolecularWeight: 404.4848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C2=C(N(N=N2)C3=CC=C(C=C3)N)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C2=C(N(N=N2)C3=CC=C(C=C3)N)C4=CC=CC=C4)C

InChI

InChI=1S/C22H20N4O2S/c1-15-8-13-20(14-16(15)2)29(27,28)22-21(17-6-4-3-5-7-17)26(25-24-22)19-11-9-18(23)10-12-19/h3-14H,23H2,1-2H3