6,7-dimethoxy-4-[4-[4-(3-methylphenoxy)butylsulfanyl]phenoxy]quinoline

Systemtic Name: 6,7-dimethoxy-4-[4-[4-(3-methylphenoxy)butylsulfanyl]phenoxy]quinoline Openeye Name: 6,7-dimethoxy-4-[4-[4-(3-methylphenoxy)butylsulfanyl]phenoxy]quinoline CAS Name: 6,7-dimethoxy-4-[4-[4-(3-methylphenoxy)butylthio]phenoxy]quinoline IUPAC Name: 6,7-dimethoxy-4-[4-[4-(3-methylphenoxy)butylsulfanyl]phenoxy]quinoline Traditional Name: 6,7-dimethoxy-4-[4-[4-(3-methylphenoxy)butylthio]phenoxy]quinoline Formula: C28H29NO4S MolecularWeight: 475.59916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCCSC2=CC=C(C=C2)OC3=C4C=C(C(=CC4=NC=C3)OC)OC

Isomeric SMILES

CC1=CC(=CC=C1)OCCCCSC2=CC=C(C=C2)OC3=C4C=C(C(=CC4=NC=C3)OC)OC

InChI

InChI=1S/C28H29NO4S/c1-20-7-6-8-22(17-20)32-15-4-5-16-34-23-11-9-21(10-12-23)33-26-13-14-29-25-19-28(31-3)27(30-2)18-24(25)26/h6-14,17-19H,4-5,15-16H2,1-3H3