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

Systemtic Name: N-(4-methoxyphenyl)-2-[4-(3-methyl-3-oxidanyl-but-1-ynyl)phenyl]-1,3-thiazolidine-3-carbothioamide Openeye Name: 2-[4-(3-hydroxy-3-methyl-but-1-ynyl)phenyl]-N-(4-methoxyphenyl)thiazolidine-3-carbothioamide CAS Name: 2-[4-(3-hydroxy-3-methylbut-1-ynyl)phenyl]-N-(4-methoxyphenyl)-3-thiazolidinecarbothioamide IUPAC Name: 2-[4-(3-hydroxy-3-methylbut-1-ynyl)phenyl]-N-(4-methoxyphenyl)-1,3-thiazolidine-3-carbothioamide Traditional Name: 2-[4-(3-hydroxy-3-methyl-but-1-ynyl)phenyl]-N-(4-methoxyphenyl)thiazolidine-3-carbothioamide Formula: C22H24N2O2S2 MolecularWeight: 412.56816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC1=CC=C(C=C1)C2N(CCS2)C(=S)NC3=CC=C(C=C3)OC)O

Isomeric SMILES

CC(C)(C#CC1=CC=C(C=C1)C2N(CCS2)C(=S)NC3=CC=C(C=C3)OC)O

InChI

InChI=1S/C22H24N2O2S2/c1-22(2,25)13-12-16-4-6-17(7-5-16)20-24(14-15-28-20)21(27)23-18-8-10-19(26-3)11-9-18/h4-11,20,25H,14-15H2,1-3H3,(H,23,27)