N-[3-methyl-5-[(4-methylsulfonylpiperazin-1-yl)methyl]phenyl]-4-(2-phenylpyrazol-3-yl)pyrimidin-2-amine

Systemtic Name: N-[3-methyl-5-[(4-methylsulfonylpiperazin-1-yl)methyl]phenyl]-4-(2-phenylpyrazol-3-yl)pyrimidin-2-amine Openeye Name: N-[3-methyl-5-[(4-methylsulfonylpiperazin-1-yl)methyl]phenyl]-4-(2-phenylpyrazol-3-yl)pyrimidin-2-amine CAS Name: N-[3-methyl-5-[(4-methylsulfonyl-1-piperazinyl)methyl]phenyl]-4-(2-phenyl-3-pyrazolyl)-2-pyrimidinamine IUPAC Name: N-[3-methyl-5-[(4-methylsulfonylpiperazin-1-yl)methyl]phenyl]-4-(2-phenylpyrazol-3-yl)pyrimidin-2-amine Traditional Name: [3-[(4-mesylpiperazino)methyl]-5-methyl-phenyl]-[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amine Formula: C26H29N7O2S MolecularWeight: 503.61916

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H29N7O2S/c1-20-16-21(19-31-12-14-32(15-13-31)36(2,34)35)18-22(17-20)29-26-27-10-8-24(30-26)25-9-11-28-33(25)23-6-4-3-5-7-23/h3-11,16-18H,12-15,19H2,1-2H3,(H,27,29,30)