3,3-dimethyl-1-(1-propylbenzimidazol-2-yl)sulfanyl-butan-2-one hydrochloride

Systemtic Name: 3,3-dimethyl-1-(1-propylbenzimidazol-2-yl)sulfanyl-butan-2-one hydrochloride Openeye Name: 3,3-dimethyl-1-(1-propylbenzimidazol-2-yl)sulfanyl-butan-2-one hydrochloride CAS Name: 3,3-dimethyl-1-[(1-propyl-2-benzimidazolyl)thio]-2-butanone hydrochloride IUPAC Name: 3,3-dimethyl-1-(1-propylbenzimidazol-2-yl)sulfanylbutan-2-one hydrochloride Traditional Name: 3,3-dimethyl-1-[(1-propylbenzimidazol-2-yl)thio]butan-2-one hydrochloride Formula: C16H23ClN2OS MolecularWeight: 326.88462

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2N=C1SCC(=O)C(C)(C)C.Cl

Isomeric SMILES

CCCN1C2=CC=CC=C2N=C1SCC(=O)C(C)(C)C.Cl

InChI

InChI=1S/C16H22N2OS.ClH/c1-5-10-18-13-9-7-6-8-12(13)17-15(18)20-11-14(19)16(2,3)4;/h6-9H,5,10-11H2,1-4H3;1H