5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(thiolan-2-ylmethyl)-1,3,5-thiadiazinane-2-thione

Systemtic Name: 5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(thiolan-2-ylmethyl)-1,3,5-thiadiazinane-2-thione Openeye Name: 5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(tetrahydrothiophen-2-ylmethyl)-1,3,5-thiadiazinane-2-thione CAS Name: 5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-thiolanylmethyl)-1,3,5-thiadiazinane-2-thione IUPAC Name: 5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(thiolan-2-ylmethyl)-1,3,5-thiadiazinane-2-thione Traditional Name: 5-homoveratryl-3-(tetrahydrothiophen-2-ylmethyl)-1,3,5-thiadiazinane-2-thione Formula: C18H26N2O2S3 MolecularWeight: 398.60624

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2CN(C(=S)SC2)CC3CCCS3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2CN(C(=S)SC2)CC3CCCS3)OC

InChI

InChI=1S/C18H26N2O2S3/c1-21-16-6-5-14(10-17(16)22-2)7-8-19-12-20(18(23)25-13-19)11-15-4-3-9-24-15/h5-6,10,15H,3-4,7-9,11-13H2,1-2H3