3H-benzimidazol-5-yl-[4-(4-phenyl-1,2,3-triazol-1-yl)piperidin-1-yl]methanone

Systemtic Name: 3H-benzimidazol-5-yl-[4-(4-phenyl-1,2,3-triazol-1-yl)piperidin-1-yl]methanone Openeye Name: 3H-benzimidazol-5-yl-[4-(4-phenyltriazol-1-yl)-1-piperidyl]methanone CAS Name: 3H-benzimidazol-5-yl-[4-(4-phenyl-1-triazolyl)-1-piperidinyl]methanone IUPAC Name: 3H-benzimidazol-5-yl-[4-(4-phenyltriazol-1-yl)piperidin-1-yl]methanone Traditional Name: 3H-benzimidazol-5-yl-[4-(4-phenyltriazol-1-yl)piperidino]methanone Formula: C21H20N6O MolecularWeight: 372.4231

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C=C(N=N2)C3=CC=CC=C3)C(=O)C4=CC5=C(C=C4)N=CN5

Isomeric SMILES

C1CN(CCC1N2C=C(N=N2)C3=CC=CC=C3)C(=O)C4=CC5=C(C=C4)N=CN5

InChI

InChI=1S/C21H20N6O/c28-21(16-6-7-18-19(12-16)23-14-22-18)26-10-8-17(9-11-26)27-13-20(24-25-27)15-4-2-1-3-5-15/h1-7,12-14,17H,8-11H2,(H,22,23)