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

Systemtic Name: N-[(4-dimethylaminophenyl)methyl]-2-ethylsulfonyl-5-(4-methylphenyl)-1,2,4-triazol-3-amine Openeye Name: N-[(4-dimethylaminophenyl)methyl]-2-ethylsulfonyl-5-(p-tolyl)-1,2,4-triazol-3-amine CAS Name: N-[(4-dimethylaminophenyl)methyl]-2-ethylsulfonyl-5-(4-methylphenyl)-1,2,4-triazol-3-amine IUPAC Name: N-[(4-dimethylaminophenyl)methyl]-2-ethylsulfonyl-5-(4-methylphenyl)-1,2,4-triazol-3-amine Traditional Name: [4-[[[2-esyl-5-(p-tolyl)-1,2,4-triazol-3-yl]amino]methyl]phenyl]-dimethyl-amine Formula: C20H25N5O2S MolecularWeight: 399.5098

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1C(=NC(=N1)C2=CC=C(C=C2)C)NCC3=CC=C(C=C3)N(C)C

Isomeric SMILES

CCS(=O)(=O)N1C(=NC(=N1)C2=CC=C(C=C2)C)NCC3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C20H25N5O2S/c1-5-28(26,27)25-20(21-14-16-8-12-18(13-9-16)24(3)4)22-19(23-25)17-10-6-15(2)7-11-17/h6-13H,5,14H2,1-4H3,(H,21,22,23)