N-(4-methoxyphenyl)-2-[5-(3-methyl-3-oxidanyl-but-1-ynyl)thiophen-2-yl]-1,3-thiazolidine-3-carbothioamide

Systemtic Name: N-(4-methoxyphenyl)-2-[5-(3-methyl-3-oxidanyl-but-1-ynyl)thiophen-2-yl]-1,3-thiazolidine-3-carbothioamide Openeye Name: 2-[5-(3-hydroxy-3-methyl-but-1-ynyl)-2-thienyl]-N-(4-methoxyphenyl)thiazolidine-3-carbothioamide CAS Name: 2-[5-(3-hydroxy-3-methylbut-1-ynyl)-2-thiophenyl]-N-(4-methoxyphenyl)-3-thiazolidinecarbothioamide IUPAC Name: 2-[5-(3-hydroxy-3-methylbut-1-ynyl)thiophen-2-yl]-N-(4-methoxyphenyl)-1,3-thiazolidine-3-carbothioamide Traditional Name: 2-[5-(3-hydroxy-3-methyl-but-1-ynyl)-2-thienyl]-N-(4-methoxyphenyl)thiazolidine-3-carbothioamide Formula: C20H22N2O2S3 MolecularWeight: 418.59588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC1=CC=C(S1)C2N(CCS2)C(=S)NC3=CC=C(C=C3)OC)O

Isomeric SMILES

CC(C)(C#CC1=CC=C(S1)C2N(CCS2)C(=S)NC3=CC=C(C=C3)OC)O

InChI

InChI=1S/C20H22N2O2S3/c1-20(2,23)11-10-16-8-9-17(27-16)18-22(12-13-26-18)19(25)21-14-4-6-15(24-3)7-5-14/h4-9,18,23H,12-13H2,1-3H3,(H,21,25)