1-(azocan-1-yl)-2-(2-propan-2-ylsulfanylbenzimidazol-1-yl)ethanone

Systemtic Name: 1-(azocan-1-yl)-2-(2-propan-2-ylsulfanylbenzimidazol-1-yl)ethanone Openeye Name: 1-(azocan-1-yl)-2-(2-isopropylsulfanylbenzimidazol-1-yl)ethanone CAS Name: 1-(1-azocanyl)-2-[2-(propan-2-ylthio)-1-benzimidazolyl]ethanone IUPAC Name: 1-(azocan-1-yl)-2-(2-propan-2-ylsulfanylbenzimidazol-1-yl)ethanone Traditional Name: 1-(azocan-1-yl)-2-[2-(isopropylthio)benzimidazol-1-yl]ethanone Formula: C19H27N3OS MolecularWeight: 345.50218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NC2=CC=CC=C2N1CC(=O)N3CCCCCCC3

Isomeric SMILES

CC(C)SC1=NC2=CC=CC=C2N1CC(=O)N3CCCCCCC3

InChI

InChI=1S/C19H27N3OS/c1-15(2)24-19-20-16-10-6-7-11-17(16)22(19)14-18(23)21-12-8-4-3-5-9-13-21/h6-7,10-11,15H,3-5,8-9,12-14H2,1-2H3