5-(4-chloranyl-2,5-dimethoxy-phenyl)-1-(2-cyclohexylethyl)-1,2,4-triazol-3-amine

Systemtic Name: 5-(4-chloranyl-2,5-dimethoxy-phenyl)-1-(2-cyclohexylethyl)-1,2,4-triazol-3-amine Openeye Name: 5-(4-chloro-2,5-dimethoxy-phenyl)-1-(2-cyclohexylethyl)-1,2,4-triazol-3-amine CAS Name: 5-(4-chloro-2,5-dimethoxyphenyl)-1-(2-cyclohexylethyl)-1,2,4-triazol-3-amine IUPAC Name: 5-(4-chloro-2,5-dimethoxyphenyl)-1-(2-cyclohexylethyl)-1,2,4-triazol-3-amine Traditional Name: [5-(4-chloro-2,5-dimethoxy-phenyl)-1-(2-cyclohexylethyl)-1,2,4-triazol-3-yl]amine Formula: C18H25ClN4O2 MolecularWeight: 364.8697

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C2=NC(=NN2CCC3CCCCC3)N)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1C2=NC(=NN2CCC3CCCCC3)N)OC)Cl

InChI

InChI=1S/C18H25ClN4O2/c1-24-15-11-14(19)16(25-2)10-13(15)17-21-18(20)22-23(17)9-8-12-6-4-3-5-7-12/h10-12H,3-9H2,1-2H3,(H2,20,22)