N-(4-morpholin-4-ylphenyl)-5-(4-propan-2-yloxyphenyl)-1H-1,2,4-triazol-3-amine

Systemtic Name: N-(4-morpholin-4-ylphenyl)-5-(4-propan-2-yloxyphenyl)-1H-1,2,4-triazol-3-amine Openeye Name: 5-(4-isopropoxyphenyl)-N-(4-morpholinophenyl)-1H-1,2,4-triazol-3-amine CAS Name: N-[4-(4-morpholinyl)phenyl]-5-(4-propan-2-yloxyphenyl)-1H-1,2,4-triazol-3-amine IUPAC Name: N-(4-morpholin-4-ylphenyl)-5-(4-propan-2-yloxyphenyl)-1H-1,2,4-triazol-3-amine Traditional Name: [5-(4-isopropoxyphenyl)-1H-1,2,4-triazol-3-yl]-(4-morpholinophenyl)amine Formula: C21H25N5O2 MolecularWeight: 379.4555

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C2=NC(=NN2)NC3=CC=C(C=C3)N4CCOCC4

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C2=NC(=NN2)NC3=CC=C(C=C3)N4CCOCC4

InChI

InChI=1S/C21H25N5O2/c1-15(2)28-19-9-3-16(4-10-19)20-23-21(25-24-20)22-17-5-7-18(8-6-17)26-11-13-27-14-12-26/h3-10,15H,11-14H2,1-2H3,(H2,22,23,24,25)