2-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-yl]sulfanyl-2,3-dihydroinden-1-one

Systemtic Name: 2-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-yl]sulfanyl-2,3-dihydroinden-1-one Openeye Name: 2-[[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-pyridyl]sulfanyl]indan-1-one CAS Name: 2-[[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-pyridinyl]thio]-2,3-dihydroinden-1-one IUPAC Name: 2-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-yl]sulfanyl-2,3-dihydroinden-1-one Traditional Name: 2-[[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-pyridyl]thio]indan-1-one Formula: C23H19N3OS MolecularWeight: 385.48146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N=C(N2)C3=CN=C(C=C3)SC4CC5=CC=CC=C5C4=O

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(N2)C3=CN=C(C=C3)SC4CC5=CC=CC=C5C4=O

InChI

InChI=1S/C23H19N3OS/c1-13-9-18-19(10-14(13)2)26-23(25-18)16-7-8-21(24-12-16)28-20-11-15-5-3-4-6-17(15)22(20)27/h3-10,12,20H,11H2,1-2H3,(H,25,26)