N-[[4-(diethylamino)phenyl]methyl]-2-methylsulfonyl-5-pyridin-3-yl-1,2,4-triazol-3-amine

Systemtic Name: N-[[4-(diethylamino)phenyl]methyl]-2-methylsulfonyl-5-pyridin-3-yl-1,2,4-triazol-3-amine Openeye Name: N-[[4-(diethylamino)phenyl]methyl]-2-methylsulfonyl-5-(3-pyridyl)-1,2,4-triazol-3-amine CAS Name: N-[[4-(diethylamino)phenyl]methyl]-2-methylsulfonyl-5-(3-pyridinyl)-1,2,4-triazol-3-amine IUPAC Name: N-[[4-(diethylamino)phenyl]methyl]-2-methylsulfonyl-5-pyridin-3-yl-1,2,4-triazol-3-amine Traditional Name: diethyl-[4-[[[2-mesyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]amino]methyl]phenyl]amine Formula: C19H24N6O2S MolecularWeight: 400.49786

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)CNC2=NC(=NN2S(=O)(=O)C)C3=CN=CC=C3

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)CNC2=NC(=NN2S(=O)(=O)C)C3=CN=CC=C3

InChI

InChI=1S/C19H24N6O2S/c1-4-24(5-2)17-10-8-15(9-11-17)13-21-19-22-18(16-7-6-12-20-14-16)23-25(19)28(3,26)27/h6-12,14H,4-5,13H2,1-3H3,(H,21,22,23)