9,10-dimethoxy-2,2,11b-trimethyl-4-methylsulfanyl-1,3,6,7-tetrahydropyrimido[6,1-a]isoquinolin-5-ium

Systemtic Name: 9,10-dimethoxy-2,2,11b-trimethyl-4-methylsulfanyl-1,3,6,7-tetrahydropyrimido[6,1-a]isoquinolin-5-ium Openeye Name: 9,10-dimethoxy-2,2,11b-trimethyl-4-methylsulfanyl-1,3,6,7-tetrahydropyrimido[6,1-a]isoquinolin-5-ium CAS Name: 9,10-dimethoxy-2,2,11b-trimethyl-4-(methylthio)-1,3,6,7-tetrahydropyrimido[6,1-a]isoquinolin-5-ium IUPAC Name: 9,10-dimethoxy-2,2,11b-trimethyl-4-methylsulfanyl-1,3,6,7-tetrahydropyrimido[6,1-a]isoquinolin-5-ium Traditional Name: 9,10-dimethoxy-2,2,11b-trimethyl-4-(methylthio)-1,3,6,7-tetrahydropyrimid[6,1-a]isoquinolin-5-ium Formula: C18H27N2O2S+ MolecularWeight: 335.48418

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2(C3=CC(=C(C=C3CC[N+]2=C(N1)SC)OC)OC)C)C

Isomeric SMILES

CC1(CC2(C3=CC(=C(C=C3CC[N+]2=C(N1)SC)OC)OC)C)C

InChI

InChI=1S/C18H26N2O2S/c1-17(2)11-18(3)13-10-15(22-5)14(21-4)9-12(13)7-8-20(18)16(19-17)23-6/h9-10H,7-8,11H2,1-6H3/p+1