4,8-dimethyl-2-[3-(4-methylphenoxy)propylsulfanyl]quinoline

Systemtic Name: 4,8-dimethyl-2-[3-(4-methylphenoxy)propylsulfanyl]quinoline Openeye Name: 4,8-dimethyl-2-[3-(4-methylphenoxy)propylsulfanyl]quinoline CAS Name: 4,8-dimethyl-2-[3-(4-methylphenoxy)propylthio]quinoline IUPAC Name: 4,8-dimethyl-2-[3-(4-methylphenoxy)propylsulfanyl]quinoline Traditional Name: 4,8-dimethyl-2-[3-(4-methylphenoxy)propylthio]quinoline Formula: C21H23NOS MolecularWeight: 337.47842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCCSC2=NC3=C(C=CC=C3C)C(=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)OCCCSC2=NC3=C(C=CC=C3C)C(=C2)C

InChI

InChI=1S/C21H23NOS/c1-15-8-10-18(11-9-15)23-12-5-13-24-20-14-17(3)19-7-4-6-16(2)21(19)22-20/h4,6-11,14H,5,12-13H2,1-3H3