6-(2-methoxyphenyl)-2,2-dimethyl-4-(1-prop-2-enylsulfanylethyl)-1H-quinoline; prop-2-ene-1-thiol

Systemtic Name: 6-(2-methoxyphenyl)-2,2-dimethyl-4-(1-prop-2-enylsulfanylethyl)-1H-quinoline; prop-2-ene-1-thiol Openeye Name: 4-(1-allylsulfanylethyl)-6-(2-methoxyphenyl)-2,2-dimethyl-1H-quinoline; prop-2-ene-1-thiol CAS Name: 6-(2-methoxyphenyl)-2,2-dimethyl-4-[1-(prop-2-enylthio)ethyl]-1H-quinoline; 2-propene-1-thiol IUPAC Name: 6-(2-methoxyphenyl)-2,2-dimethyl-4-(1-prop-2-enylsulfanylethyl)-1H-quinoline; prop-2-ene-1-thiol Traditional Name: 4-[1-(allylthio)ethyl]-6-(2-methoxyphenyl)-2,2-dimethyl-1H-quinoline; prop-2-ene-1-thiol Formula: C26H33NOS2 MolecularWeight: 439.67632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(NC2=C1C=C(C=C2)C3=CC=CC=C3OC)(C)C)SCC=C.C=CCS

Isomeric SMILES

CC(C1=CC(NC2=C1C=C(C=C2)C3=CC=CC=C3OC)(C)C)SCC=C.C=CCS

InChI

InChI=1S/C23H27NOS.C3H6S/c1-6-13-26-16(2)20-15-23(3,4)24-21-12-11-17(14-19(20)21)18-9-7-8-10-22(18)25-5;1-2-3-4/h6-12,14-16,24H,1,13H2,2-5H3;2,4H,1,3H2