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

Systemtic Name: 4-(3-morpholin-4-ylphenyl)-N-[4-(3-pyridin-2-yl-1,2,4-triazol-1-yl)phenyl]pyrimidin-2-amine Openeye Name: 4-(3-morpholinophenyl)-N-[4-[3-(2-pyridyl)-1,2,4-triazol-1-yl]phenyl]pyrimidin-2-amine CAS Name: 4-[3-(4-morpholinyl)phenyl]-N-[4-[3-(2-pyridinyl)-1,2,4-triazol-1-yl]phenyl]-2-pyrimidinamine IUPAC Name: 4-(3-morpholin-4-ylphenyl)-N-[4-(3-pyridin-2-yl-1,2,4-triazol-1-yl)phenyl]pyrimidin-2-amine Traditional Name: [4-(3-morpholinophenyl)pyrimidin-2-yl]-[4-[3-(2-pyridyl)-1,2,4-triazol-1-yl]phenyl]amine Formula: C27H24N8O MolecularWeight: 476.53246

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=CC(=C2)C3=NC(=NC=C3)NC4=CC=C(C=C4)N5C=NC(=N5)C6=CC=CC=N6

Isomeric SMILES

C1COCCN1C2=CC=CC(=C2)C3=NC(=NC=C3)NC4=CC=C(C=C4)N5C=NC(=N5)C6=CC=CC=N6

InChI

InChI=1S/C27H24N8O/c1-2-12-28-25(6-1)26-30-19-35(33-26)22-9-7-21(8-10-22)31-27-29-13-11-24(32-27)20-4-3-5-23(18-20)34-14-16-36-17-15-34/h1-13,18-19H,14-17H2,(H,29,31,32)