1-imidazol-1-yl-3-(4-phenylsulfanylphenyl)heptan-3-ol

Systemtic Name: 1-imidazol-1-yl-3-(4-phenylsulfanylphenyl)heptan-3-ol Openeye Name: 1-imidazol-1-yl-3-(4-phenylsulfanylphenyl)heptan-3-ol CAS Name: 1-(1-imidazolyl)-3-[4-(phenylthio)phenyl]-3-heptanol IUPAC Name: 1-imidazol-1-yl-3-(4-phenylsulfanylphenyl)heptan-3-ol Traditional Name: 1-imidazol-1-yl-3-[4-(phenylthio)phenyl]heptan-3-ol Formula: C22H26N2OS MolecularWeight: 366.51964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCN1C=CN=C1)(C2=CC=C(C=C2)SC3=CC=CC=C3)O

Isomeric SMILES

CCCCC(CCN1C=CN=C1)(C2=CC=C(C=C2)SC3=CC=CC=C3)O

InChI

InChI=1S/C22H26N2OS/c1-2-3-13-22(25,14-16-24-17-15-23-18-24)19-9-11-21(12-10-19)26-20-7-5-4-6-8-20/h4-12,15,17-18,25H,2-3,13-14,16H2,1H3