N-[2-methyl-6-[(4-methylsulfonylpiperazin-1-yl)methyl]pyridin-4-yl]-4-(2-phenylpyrazol-3-yl)pyrimidin-2-amine

Systemtic Name: N-[2-methyl-6-[(4-methylsulfonylpiperazin-1-yl)methyl]pyridin-4-yl]-4-(2-phenylpyrazol-3-yl)pyrimidin-2-amine Openeye Name: N-[2-methyl-6-[(4-methylsulfonylpiperazin-1-yl)methyl]-4-pyridyl]-4-(2-phenylpyrazol-3-yl)pyrimidin-2-amine CAS Name: N-[2-methyl-6-[(4-methylsulfonyl-1-piperazinyl)methyl]-4-pyridinyl]-4-(2-phenyl-3-pyrazolyl)-2-pyrimidinamine IUPAC Name: N-[2-methyl-6-[(4-methylsulfonylpiperazin-1-yl)methyl]pyridin-4-yl]-4-(2-phenylpyrazol-3-yl)pyrimidin-2-amine Traditional Name: [2-[(4-mesylpiperazino)methyl]-6-methyl-4-pyridyl]-[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amine Formula: C25H28N8O2S MolecularWeight: 504.60722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=C1)NC2=NC=CC(=N2)C3=CC=NN3C4=CC=CC=C4)CN5CCN(CC5)S(=O)(=O)C

Isomeric SMILES

CC1=NC(=CC(=C1)NC2=NC=CC(=N2)C3=CC=NN3C4=CC=CC=C4)CN5CCN(CC5)S(=O)(=O)C

InChI

InChI=1S/C25H28N8O2S/c1-19-16-20(17-21(28-19)18-31-12-14-32(15-13-31)36(2,34)35)29-25-26-10-8-23(30-25)24-9-11-27-33(24)22-6-4-3-5-7-22/h3-11,16-17H,12-15,18H2,1-2H3,(H,26,28,29,30)