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

Systemtic Name: 4-(3-methylsulfonyl-5-morpholin-4-yl-phenyl)-N-[4-(3-methyl-1,2,4-triazol-1-yl)phenyl]pyrimidin-2-amine Openeye Name: 4-(3-methylsulfonyl-5-morpholino-phenyl)-N-[4-(3-methyl-1,2,4-triazol-1-yl)phenyl]pyrimidin-2-amine CAS Name: 4-[3-methylsulfonyl-5-(4-morpholinyl)phenyl]-N-[4-(3-methyl-1,2,4-triazol-1-yl)phenyl]-2-pyrimidinamine IUPAC Name: 4-(3-methylsulfonyl-5-morpholin-4-ylphenyl)-N-[4-(3-methyl-1,2,4-triazol-1-yl)phenyl]pyrimidin-2-amine Traditional Name: [4-(3-mesyl-5-morpholino-phenyl)pyrimidin-2-yl]-[4-(3-methyl-1,2,4-triazol-1-yl)phenyl]amine Formula: C24H25N7O3S MolecularWeight: 491.5654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=N1)C2=CC=C(C=C2)NC3=NC=CC(=N3)C4=CC(=CC(=C4)S(=O)(=O)C)N5CCOCC5

Isomeric SMILES

CC1=NN(C=N1)C2=CC=C(C=C2)NC3=NC=CC(=N3)C4=CC(=CC(=C4)S(=O)(=O)C)N5CCOCC5

InChI

InChI=1S/C24H25N7O3S/c1-17-26-16-31(29-17)20-5-3-19(4-6-20)27-24-25-8-7-23(28-24)18-13-21(30-9-11-34-12-10-30)15-22(14-18)35(2,32)33/h3-8,13-16H,9-12H2,1-2H3,(H,25,27,28)