N-(4-chlorophenyl)-1-(3-morpholin-4-yl-1H-1,2,4-triazol-5-yl)propane-1,3-diamine

Systemtic Name: N-(4-chlorophenyl)-1-(3-morpholin-4-yl-1H-1,2,4-triazol-5-yl)propane-1,3-diamine Openeye Name: N-(4-chlorophenyl)-1-(3-morpholino-1H-1,2,4-triazol-5-yl)propane-1,3-diamine CAS Name: N-(4-chlorophenyl)-1-[3-(4-morpholinyl)-1H-1,2,4-triazol-5-yl]propane-1,3-diamine IUPAC Name: N-(4-chlorophenyl)-1-(3-morpholin-4-yl-1H-1,2,4-triazol-5-yl)propane-1,3-diamine Traditional Name: [3-amino-1-(3-morpholino-1H-1,2,4-triazol-5-yl)propyl]-(4-chlorophenyl)amine Formula: C15H21ClN6O MolecularWeight: 336.81984

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NNC(=N2)C(CCN)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C1COCCN1C2=NNC(=N2)C(CCN)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H21ClN6O/c16-11-1-3-12(4-2-11)18-13(5-6-17)14-19-15(21-20-14)22-7-9-23-10-8-22/h1-4,13,18H,5-10,17H2,(H,19,20,21)