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

Systemtic Name: 4-(3-methylsulfonyl-5-morpholin-4-yl-phenyl)-N-[4-(3-pyridin-2-yl-1,2,4-triazol-1-yl)phenyl]pyrimidin-2-amine Openeye Name: 4-(3-methylsulfonyl-5-morpholino-phenyl)-N-[4-[3-(2-pyridyl)-1,2,4-triazol-1-yl]phenyl]pyrimidin-2-amine CAS Name: 4-[3-methylsulfonyl-5-(4-morpholinyl)phenyl]-N-[4-[3-(2-pyridinyl)-1,2,4-triazol-1-yl]phenyl]-2-pyrimidinamine IUPAC Name: 4-(3-methylsulfonyl-5-morpholin-4-ylphenyl)-N-[4-(3-pyridin-2-yl-1,2,4-triazol-1-yl)phenyl]pyrimidin-2-amine Traditional Name: [4-(3-mesyl-5-morpholino-phenyl)pyrimidin-2-yl]-[4-[3-(2-pyridyl)-1,2,4-triazol-1-yl]phenyl]amine Formula: C28H26N8O3S MolecularWeight: 554.62284

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=CC(=C1)N2CCOCC2)C3=NC(=NC=C3)NC4=CC=C(C=C4)N5C=NC(=N5)C6=CC=CC=N6

Isomeric SMILES

CS(=O)(=O)C1=CC(=CC(=C1)N2CCOCC2)C3=NC(=NC=C3)NC4=CC=C(C=C4)N5C=NC(=N5)C6=CC=CC=N6

InChI

InChI=1S/C28H26N8O3S/c1-40(37,38)24-17-20(16-23(18-24)35-12-14-39-15-13-35)25-9-11-30-28(33-25)32-21-5-7-22(8-6-21)36-19-31-27(34-36)26-4-2-3-10-29-26/h2-11,16-19H,12-15H2,1H3,(H,30,32,33)