3-[3-[2-oxidanylidene-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]sulfanylpropyl]-1H-benzimidazol-2-one

Systemtic Name: 3-[3-[2-oxidanylidene-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]sulfanylpropyl]-1H-benzimidazol-2-one Openeye Name: 3-[3-[2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]sulfanylpropyl]-1H-benzimidazol-2-one CAS Name: 3-[3-[[2-oxo-2-(1,2,5-trimethyl-3-pyrrolyl)ethyl]thio]propyl]-1H-benzimidazol-2-one IUPAC Name: 3-[3-[2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]sulfanylpropyl]-1H-benzimidazol-2-one Traditional Name: 3-[3-[[2-keto-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]thio]propyl]-1H-benzimidazol-2-one Formula: C19H23N3O2S MolecularWeight: 357.46982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C)C)C(=O)CSCCCN2C3=CC=CC=C3NC2=O

Isomeric SMILES

CC1=CC(=C(N1C)C)C(=O)CSCCCN2C3=CC=CC=C3NC2=O

InChI

InChI=1S/C19H23N3O2S/c1-13-11-15(14(2)21(13)3)18(23)12-25-10-6-9-22-17-8-5-4-7-16(17)20-19(22)24/h4-5,7-8,11H,6,9-10,12H2,1-3H3,(H,20,24)