[5-[[5-(4-methoxyphenyl)pyrimidin-2-yl]amino]pyridin-2-yl]-(4-methylsulfonylpiperazin-1-yl)methanone

Systemtic Name: [5-[[5-(4-methoxyphenyl)pyrimidin-2-yl]amino]pyridin-2-yl]-(4-methylsulfonylpiperazin-1-yl)methanone Openeye Name: [5-[[5-(4-methoxyphenyl)pyrimidin-2-yl]amino]-2-pyridyl]-(4-methylsulfonylpiperazin-1-yl)methanone CAS Name: [5-[[5-(4-methoxyphenyl)-2-pyrimidinyl]amino]-2-pyridinyl]-(4-methylsulfonyl-1-piperazinyl)methanone IUPAC Name: [5-[[5-(4-methoxyphenyl)pyrimidin-2-yl]amino]pyridin-2-yl]-(4-methylsulfonylpiperazin-1-yl)methanone Traditional Name: (4-mesylpiperazino)-[5-[[5-(4-methoxyphenyl)pyrimidin-2-yl]amino]-2-pyridyl]methanone Formula: C22H24N6O4S MolecularWeight: 468.52876

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CN=C(N=C2)NC3=CN=C(C=C3)C(=O)N4CCN(CC4)S(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)C2=CN=C(N=C2)NC3=CN=C(C=C3)C(=O)N4CCN(CC4)S(=O)(=O)C

InChI

InChI=1S/C22H24N6O4S/c1-32-19-6-3-16(4-7-19)17-13-24-22(25-14-17)26-18-5-8-20(23-15-18)21(29)27-9-11-28(12-10-27)33(2,30)31/h3-8,13-15H,9-12H2,1-2H3,(H,24,25,26)