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

Systemtic Name: N-(4-morpholin-4-ylphenyl)-5-(4-propan-2-ylphenyl)-1H-1,2,4-triazol-3-amine Openeye Name: 5-(4-isopropylphenyl)-N-(4-morpholinophenyl)-1H-1,2,4-triazol-3-amine CAS Name: N-[4-(4-morpholinyl)phenyl]-5-(4-propan-2-ylphenyl)-1H-1,2,4-triazol-3-amine IUPAC Name: N-(4-morpholin-4-ylphenyl)-5-(4-propan-2-ylphenyl)-1H-1,2,4-triazol-3-amine Traditional Name: (4-morpholinophenyl)-(5-p-cumenyl-1H-1,2,4-triazol-3-yl)amine Formula: C21H25N5O MolecularWeight: 363.4561

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N5O/c1-15(2)16-3-5-17(6-4-16)20-23-21(25-24-20)22-18-7-9-19(10-8-18)26-11-13-27-14-12-26/h3-10,15H,11-14H2,1-2H3,(H2,22,23,24,25)