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

Systemtic Name: 2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]-2,3-dihydroinden-1-one Openeye Name: 2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]indan-1-one CAS Name: 2-[(6-nitro-1H-benzimidazol-2-yl)thio]-2,3-dihydroinden-1-one IUPAC Name: 2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]-2,3-dihydroinden-1-one Traditional Name: 2-[(6-nitro-1H-benzimidazol-2-yl)thio]indan-1-one Formula: C16H11N3O3S MolecularWeight: 325.34184

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)C2=CC=CC=C21)SC3=NC4=C(N3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1C(C(=O)C2=CC=CC=C21)SC3=NC4=C(N3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C16H11N3O3S/c20-15-11-4-2-1-3-9(11)7-14(15)23-16-17-12-6-5-10(19(21)22)8-13(12)18-16/h1-6,8,14H,7H2,(H,17,18)