(3S)-4-[[5-(benzimidazol-1-ylmethyl)-1H-pyrazol-3-yl]carbonyl]-1,3-dimethyl-piperazin-2-one

Systemtic Name: (3S)-4-[[5-(benzimidazol-1-ylmethyl)-1H-pyrazol-3-yl]carbonyl]-1,3-dimethyl-piperazin-2-one Openeye Name: (3S)-4-[5-(benzimidazol-1-ylmethyl)-1H-pyrazole-3-carbonyl]-1,3-dimethyl-piperazin-2-one CAS Name: (3S)-4-[[5-(1-benzimidazolylmethyl)-1H-pyrazol-3-yl]-oxomethyl]-1,3-dimethyl-2-piperazinone IUPAC Name: (3S)-4-[5-(benzimidazol-1-ylmethyl)-1H-pyrazole-3-carbonyl]-1,3-dimethylpiperazin-2-one Traditional Name: (3S)-4-[5-(benzimidazol-1-ylmethyl)-1H-pyrazole-3-carbonyl]-1,3-dimethyl-piperazin-2-one Formula: C18H20N6O2 MolecularWeight: 352.3904

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CCN1C(=O)C2=NNC(=C2)CN3C=NC4=CC=CC=C43)C

Isomeric SMILES

C[C@H]1C(=O)N(CCN1C(=O)C2=NNC(=C2)CN3C=NC4=CC=CC=C43)C

InChI

InChI=1S/C18H20N6O2/c1-12-17(25)22(2)7-8-24(12)18(26)15-9-13(20-21-15)10-23-11-19-14-5-3-4-6-16(14)23/h3-6,9,11-12H,7-8,10H2,1-2H3,(H,20,21)/t12-/m0/s1