[4-[2-(1H-benzimidazol-2-ylsulfanyl)ethoxy]-3-methyl-pyridin-2-yl]methanethiol

Systemtic Name: [4-[2-(1H-benzimidazol-2-ylsulfanyl)ethoxy]-3-methyl-pyridin-2-yl]methanethiol Openeye Name: [4-[2-(1H-benzimidazol-2-ylsulfanyl)ethoxy]-3-methyl-2-pyridyl]methanethiol CAS Name: [4-[2-(1H-benzimidazol-2-ylthio)ethoxy]-3-methyl-2-pyridinyl]methanethiol IUPAC Name: [4-[2-(1H-benzimidazol-2-ylsulfanyl)ethoxy]-3-methylpyridin-2-yl]methanethiol Traditional Name: [4-[2-(1H-benzimidazol-2-ylthio)ethoxy]-3-methyl-2-pyridyl]methanethiol Formula: C16H17N3OS2 MolecularWeight: 331.45568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1CS)OCCSC2=NC3=CC=CC=C3N2

Isomeric SMILES

CC1=C(C=CN=C1CS)OCCSC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C16H17N3OS2/c1-11-14(10-21)17-7-6-15(11)20-8-9-22-16-18-12-4-2-3-5-13(12)19-16/h2-7,21H,8-10H2,1H3,(H,18,19)