3-[3-(4-chloranyl-2-nitro-phenyl)sulfanylpropyl]-1H-benzimidazol-2-one

Systemtic Name: 3-[3-(4-chloranyl-2-nitro-phenyl)sulfanylpropyl]-1H-benzimidazol-2-one Openeye Name: 3-[3-(4-chloro-2-nitro-phenyl)sulfanylpropyl]-1H-benzimidazol-2-one CAS Name: 3-[3-[(4-chloro-2-nitrophenyl)thio]propyl]-1H-benzimidazol-2-one IUPAC Name: 3-[3-(4-chloro-2-nitrophenyl)sulfanylpropyl]-1H-benzimidazol-2-one Traditional Name: 3-[3-[(4-chloro-2-nitro-phenyl)thio]propyl]-1H-benzimidazol-2-one Formula: C16H14ClN3O3S MolecularWeight: 363.81866

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=O)N2CCCSC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=O)N2CCCSC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H14ClN3O3S/c17-11-6-7-15(14(10-11)20(22)23)24-9-3-8-19-13-5-2-1-4-12(13)18-16(19)21/h1-2,4-7,10H,3,8-9H2,(H,18,21)