3-[1-[4-(1,2,4-triazol-1-yl)phenyl]carbonylpiperidin-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-[1-[4-(1,2,4-triazol-1-yl)phenyl]carbonylpiperidin-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-[4-(1,2,4-triazol-1-yl)benzoyl]-4-piperidyl]-1H-benzimidazol-2-one CAS Name: 3-[1-[oxo-[4-(1,2,4-triazol-1-yl)phenyl]methyl]-4-piperidinyl]-1H-benzimidazol-2-one IUPAC Name: 3-[1-[4-(1,2,4-triazol-1-yl)benzoyl]piperidin-4-yl]-1H-benzimidazol-2-one Traditional Name: 3-[1-[4-(1,2,4-triazol-1-yl)benzoyl]-4-piperidyl]-1H-benzimidazol-2-one Formula: C21H20N6O2 MolecularWeight: 388.4225

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=CC=CC=C3NC2=O)C(=O)C4=CC=C(C=C4)N5C=NC=N5

Isomeric SMILES

C1CN(CCC1N2C3=CC=CC=C3NC2=O)C(=O)C4=CC=C(C=C4)N5C=NC=N5

InChI

InChI=1S/C21H20N6O2/c28-20(15-5-7-16(8-6-15)26-14-22-13-23-26)25-11-9-17(10-12-25)27-19-4-2-1-3-18(19)24-21(27)29/h1-8,13-14,17H,9-12H2,(H,24,29)