1,3-diethyl-5-(2-quinolin-2-ylsulfanylethanoyl)benzimidazol-2-one

Systemtic Name: 1,3-diethyl-5-(2-quinolin-2-ylsulfanylethanoyl)benzimidazol-2-one Openeye Name: 1,3-diethyl-5-[2-(2-quinolylsulfanyl)acetyl]benzimidazol-2-one CAS Name: 1,3-diethyl-5-[1-oxo-2-(2-quinolinylthio)ethyl]-2-benzimidazolone IUPAC Name: 1,3-diethyl-5-(2-quinolin-2-ylsulfanylacetyl)benzimidazol-2-one Traditional Name: 1,3-diethyl-5-[2-(2-quinolylthio)acetyl]benzimidazol-2-one Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)CSC3=NC4=CC=CC=C4C=C3)N(C1=O)CC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)CSC3=NC4=CC=CC=C4C=C3)N(C1=O)CC

InChI

InChI=1S/C22H21N3O2S/c1-3-24-18-11-9-16(13-19(18)25(4-2)22(24)27)20(26)14-28-21-12-10-15-7-5-6-8-17(15)23-21/h5-13H,3-4,14H2,1-2H3