3-[bis(butylsulfanyl)methyl]-2-methyl-4-phenoxy-quinoline

Systemtic Name: 3-[bis(butylsulfanyl)methyl]-2-methyl-4-phenoxy-quinoline Openeye Name: 3-[bis(butylsulfanyl)methyl]-2-methyl-4-phenoxy-quinoline CAS Name: 3-[bis(butylthio)methyl]-2-methyl-4-phenoxyquinoline IUPAC Name: 3-[bis(butylsulfanyl)methyl]-2-methyl-4-phenoxyquinoline Traditional Name: 3-[bis(butylthio)methyl]-2-methyl-4-phenoxy-quinoline Formula: C25H31NOS2 MolecularWeight: 425.64974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC(C1=C(C2=CC=CC=C2N=C1C)OC3=CC=CC=C3)SCCCC

Isomeric SMILES

CCCCSC(C1=C(C2=CC=CC=C2N=C1C)OC3=CC=CC=C3)SCCCC

InChI

InChI=1S/C25H31NOS2/c1-4-6-17-28-25(29-18-7-5-2)23-19(3)26-22-16-12-11-15-21(22)24(23)27-20-13-9-8-10-14-20/h8-16,25H,4-7,17-18H2,1-3H3