2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-3-pentadecyl-phenol

Systemtic Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-3-pentadecyl-phenol Openeye Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-3-pentadecyl-phenol CAS Name: 2-[[(6-methoxy-1H-benzimidazol-2-yl)thio]methyl]-3-pentadecylphenol IUPAC Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-3-pentadecylphenol Traditional Name: 2-[[(6-methoxy-1H-benzimidazol-2-yl)thio]methyl]-3-pentadecyl-phenol Formula: C30H44N2O2S MolecularWeight: 496.74756

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=C(C(=CC=C1)O)CSC2=NC3=C(N2)C=C(C=C3)OC

Isomeric SMILES

CCCCCCCCCCCCCCCC1=C(C(=CC=C1)O)CSC2=NC3=C(N2)C=C(C=C3)OC

InChI

InChI=1S/C30H44N2O2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-17-24-18-16-19-29(33)26(24)23-35-30-31-27-21-20-25(34-2)22-28(27)32-30/h16,18-22,33H,3-15,17,23H2,1-2H3,(H,31,32)