3-[3-[(4-pyrazol-1-ylphenyl)methylsulfanyl]propyl]-1H-benzimidazol-2-one

Systemtic Name: 3-[3-[(4-pyrazol-1-ylphenyl)methylsulfanyl]propyl]-1H-benzimidazol-2-one Openeye Name: 3-[3-[(4-pyrazol-1-ylphenyl)methylsulfanyl]propyl]-1H-benzimidazol-2-one CAS Name: 3-[3-[[4-(1-pyrazolyl)phenyl]methylthio]propyl]-1H-benzimidazol-2-one IUPAC Name: 3-[3-[(4-pyrazol-1-ylphenyl)methylsulfanyl]propyl]-1H-benzimidazol-2-one Traditional Name: 3-[3-[(4-pyrazol-1-ylbenzyl)thio]propyl]-1H-benzimidazol-2-one Formula: C20H20N4OS MolecularWeight: 364.464

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=O)N2CCCSCC3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

C1=CC=C2C(=C1)NC(=O)N2CCCSCC3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C20H20N4OS/c25-20-22-18-5-1-2-6-19(18)23(20)12-4-14-26-15-16-7-9-17(10-8-16)24-13-3-11-21-24/h1-3,5-11,13H,4,12,14-15H2,(H,22,25)