1-[2,3-dimethyl-5-[5-(3,4,5-trimethoxyphenyl)thiolan-2-yl]phenyl]sulfanylethanamine

Systemtic Name: 1-[2,3-dimethyl-5-[5-(3,4,5-trimethoxyphenyl)thiolan-2-yl]phenyl]sulfanylethanamine Openeye Name: 1-[2,3-dimethyl-5-[5-(3,4,5-trimethoxyphenyl)tetrahydrothiophen-2-yl]phenyl]sulfanylethanamine CAS Name: 1-[[2,3-dimethyl-5-[5-(3,4,5-trimethoxyphenyl)-2-thiolanyl]phenyl]thio]ethanamine IUPAC Name: 1-[2,3-dimethyl-5-[5-(3,4,5-trimethoxyphenyl)thiolan-2-yl]phenyl]sulfanylethanamine Traditional Name: 1-[[2,3-dimethyl-5-[5-(3,4,5-trimethoxyphenyl)tetrahydrothiophen-2-yl]phenyl]thio]ethylamine Formula: C23H31NO3S2 MolecularWeight: 433.62714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C2CCC(S2)C3=CC(=C(C(=C3)OC)OC)OC)SC(C)N)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C2CCC(S2)C3=CC(=C(C(=C3)OC)OC)OC)SC(C)N)C

InChI

InChI=1S/C23H31NO3S2/c1-13-9-16(12-22(14(13)2)28-15(3)24)20-7-8-21(29-20)17-10-18(25-4)23(27-6)19(11-17)26-5/h9-12,15,20-21H,7-8,24H2,1-6H3