N-[(4-dimethylaminophenyl)methyl]-5-(4-methylphenyl)-2-methylsulfonyl-1,2,4-triazol-3-amine

Systemtic Name: N-[(4-dimethylaminophenyl)methyl]-5-(4-methylphenyl)-2-methylsulfonyl-1,2,4-triazol-3-amine Openeye Name: N-[(4-dimethylaminophenyl)methyl]-2-methylsulfonyl-5-(p-tolyl)-1,2,4-triazol-3-amine CAS Name: N-[(4-dimethylaminophenyl)methyl]-5-(4-methylphenyl)-2-methylsulfonyl-1,2,4-triazol-3-amine IUPAC Name: N-[(4-dimethylaminophenyl)methyl]-5-(4-methylphenyl)-2-methylsulfonyl-1,2,4-triazol-3-amine Traditional Name: [4-[[[2-mesyl-5-(p-tolyl)-1,2,4-triazol-3-yl]amino]methyl]phenyl]-dimethyl-amine Formula: C19H23N5O2S MolecularWeight: 385.48322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=C(C=C3)N(C)C)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=C(C=C3)N(C)C)S(=O)(=O)C

InChI

InChI=1S/C19H23N5O2S/c1-14-5-9-16(10-6-14)18-21-19(24(22-18)27(4,25)26)20-13-15-7-11-17(12-8-15)23(2)3/h5-12H,13H2,1-4H3,(H,20,21,22)