N-[2-methyl-5-[5-(3-methylsulfonylphenyl)-3H-1,2,4-triazol-3-yl]phenyl]-4-pyridin-3-yl-pyrimidin-2-amine

Systemtic Name: N-[2-methyl-5-[5-(3-methylsulfonylphenyl)-3H-1,2,4-triazol-3-yl]phenyl]-4-pyridin-3-yl-pyrimidin-2-amine Openeye Name: N-[2-methyl-5-[5-(3-methylsulfonylphenyl)-3H-1,2,4-triazol-3-yl]phenyl]-4-(3-pyridyl)pyrimidin-2-amine CAS Name: N-[2-methyl-5-[5-(3-methylsulfonylphenyl)-3H-1,2,4-triazol-3-yl]phenyl]-4-(3-pyridinyl)-2-pyrimidinamine IUPAC Name: N-[2-methyl-5-[5-(3-methylsulfonylphenyl)-3H-1,2,4-triazol-3-yl]phenyl]-4-pyridin-3-ylpyrimidin-2-amine Traditional Name: [5-[5-(3-mesylphenyl)-3H-1,2,4-triazol-3-yl]-2-methyl-phenyl]-[4-(3-pyridyl)pyrimidin-2-yl]amine Formula: C25H21N7O2S MolecularWeight: 483.54494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2N=C(N=N2)C3=CC(=CC=C3)S(=O)(=O)C)NC4=NC=CC(=N4)C5=CN=CC=C5

Isomeric SMILES

CC1=C(C=C(C=C1)C2N=C(N=N2)C3=CC(=CC=C3)S(=O)(=O)C)NC4=NC=CC(=N4)C5=CN=CC=C5

InChI

InChI=1S/C25H21N7O2S/c1-16-8-9-18(24-30-23(31-32-24)17-5-3-7-20(13-17)35(2,33)34)14-22(16)29-25-27-12-10-21(28-25)19-6-4-11-26-15-19/h3-15,24H,1-2H3,(H,27,28,29)