6-(2-methoxyphenyl)-2,2-dimethyl-4-(3-methylbutylsulfanylmethyl)-1H-quinoline

Systemtic Name: 6-(2-methoxyphenyl)-2,2-dimethyl-4-(3-methylbutylsulfanylmethyl)-1H-quinoline Openeye Name: 4-(isopentylsulfanylmethyl)-6-(2-methoxyphenyl)-2,2-dimethyl-1H-quinoline CAS Name: 6-(2-methoxyphenyl)-2,2-dimethyl-4-[(3-methylbutylthio)methyl]-1H-quinoline IUPAC Name: 6-(2-methoxyphenyl)-2,2-dimethyl-4-(3-methylbutylsulfanylmethyl)-1H-quinoline Traditional Name: 4-[(isoamylthio)methyl]-6-(2-methoxyphenyl)-2,2-dimethyl-1H-quinoline Formula: C24H31NOS MolecularWeight: 381.57404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSCC1=CC(NC2=C1C=C(C=C2)C3=CC=CC=C3OC)(C)C

Isomeric SMILES

CC(C)CCSCC1=CC(NC2=C1C=C(C=C2)C3=CC=CC=C3OC)(C)C

InChI

InChI=1S/C24H31NOS/c1-17(2)12-13-27-16-19-15-24(3,4)25-22-11-10-18(14-21(19)22)20-8-6-7-9-23(20)26-5/h6-11,14-15,17,25H,12-13,16H2,1-5H3