1-[2-(hydroxymethyl)-1,6-dimethyl-benzimidazol-5-yl]-4-methylsulfanyl-butan-1-one

Systemtic Name: 1-[2-(hydroxymethyl)-1,6-dimethyl-benzimidazol-5-yl]-4-methylsulfanyl-butan-1-one Openeye Name: 1-[2-(hydroxymethyl)-1,6-dimethyl-benzimidazol-5-yl]-4-methylsulfanyl-butan-1-one CAS Name: 1-[2-(hydroxymethyl)-1,6-dimethyl-5-benzimidazolyl]-4-(methylthio)-1-butanone IUPAC Name: 1-[2-(hydroxymethyl)-1,6-dimethylbenzimidazol-5-yl]-4-methylsulfanylbutan-1-one Traditional Name: 1-(1,6-dimethyl-2-methylol-benzimidazol-5-yl)-4-(methylthio)butan-1-one Formula: C15H20N2O2S MolecularWeight: 292.3965

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C(=O)CCCSC)N=C(N2C)CO

Isomeric SMILES

CC1=CC2=C(C=C1C(=O)CCCSC)N=C(N2C)CO

InChI

InChI=1S/C15H20N2O2S/c1-10-7-13-12(16-15(9-18)17(13)2)8-11(10)14(19)5-4-6-20-3/h7-8,18H,4-6,9H2,1-3H3