1-(butylsulfanylmethyl)-4-(chloromethyl)-5-(3,7-dimethyloctoxy)-2-methoxy-benzene; thiolan-1-ium

Systemtic Name: 1-(butylsulfanylmethyl)-4-(chloromethyl)-5-(3,7-dimethyloctoxy)-2-methoxy-benzene; thiolan-1-ium Openeye Name: 1-(butylsulfanylmethyl)-4-(chloromethyl)-5-(3,7-dimethyloctoxy)-2-methoxy-benzene; tetrahydrothiophen-1-ium CAS Name: 1-[(butylthio)methyl]-4-(chloromethyl)-5-(3,7-dimethyloctoxy)-2-methoxybenzene; thiolan-1-ium IUPAC Name: 1-(butylsulfanylmethyl)-4-(chloromethyl)-5-(3,7-dimethyloctoxy)-2-methoxybenzene; thiolan-1-ium Traditional Name: 1-[(butylthio)methyl]-4-(chloromethyl)-5-(3,7-dimethyloctoxy)-2-methoxy-benzene; tetrahydrothiophen-1-ium Formula: C27H48ClO2S2+ MolecularWeight: 504.25182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCC1=CC(=C(C=C1OC)CCl)OCCC(C)CCCC(C)C.C1CC[SH+]C1

Isomeric SMILES

CCCCSCC1=CC(=C(C=C1OC)CCl)OCCC(C)CCCC(C)C.C1CC[SH+]C1

InChI

InChI=1S/C23H39ClO2S.C4H8S/c1-6-7-13-27-17-21-15-23(20(16-24)14-22(21)25-5)26-12-11-19(4)10-8-9-18(2)3;1-2-4-5-3-1/h14-15,18-19H,6-13,16-17H2,1-5H3;1-4H2/p+1