4-(1H-benzimidazol-4-ylmethylsulfanylmethyl)-6-methyl-2-phenethyl-pyridin-3-ol hydrochloride

Systemtic Name: 4-(1H-benzimidazol-4-ylmethylsulfanylmethyl)-6-methyl-2-phenethyl-pyridin-3-ol hydrochloride Openeye Name: 4-(1H-benzimidazol-4-ylmethylsulfanylmethyl)-6-methyl-2-phenethyl-pyridin-3-ol hydrochloride CAS Name: 4-[(1H-benzimidazol-4-ylmethylthio)methyl]-6-methyl-2-phenethyl-3-pyridinol hydrochloride IUPAC Name: 4-(1H-benzimidazol-4-ylmethylsulfanylmethyl)-6-methyl-2-phenethylpyridin-3-ol hydrochloride Traditional Name: 4-[(1H-benzimidazol-4-ylmethylthio)methyl]-6-methyl-2-phenethyl-pyridin-3-ol hydrochloride Formula: C23H24ClN3OS MolecularWeight: 425.97416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)CSCC2=C3C(=CC=C2)NC=N3)O)CCC4=CC=CC=C4.Cl

Isomeric SMILES

CC1=NC(=C(C(=C1)CSCC2=C3C(=CC=C2)NC=N3)O)CCC4=CC=CC=C4.Cl

InChI

InChI=1S/C23H23N3OS.ClH/c1-16-12-19(14-28-13-18-8-5-9-20-22(18)25-15-24-20)23(27)21(26-16)11-10-17-6-3-2-4-7-17;/h2-9,12,15,27H,10-11,13-14H2,1H3,(H,24,25);1H