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

Systemtic Name: 2-[4-(3-methyl-3-oxidanyl-but-1-ynyl)phenyl]-N-(4-methylphenyl)-1,3-thiazolidine-3-carbothioamide Openeye Name: 2-[4-(3-hydroxy-3-methyl-but-1-ynyl)phenyl]-N-(p-tolyl)thiazolidine-3-carbothioamide CAS Name: 2-[4-(3-hydroxy-3-methylbut-1-ynyl)phenyl]-N-(4-methylphenyl)-3-thiazolidinecarbothioamide IUPAC Name: 2-[4-(3-hydroxy-3-methylbut-1-ynyl)phenyl]-N-(4-methylphenyl)-1,3-thiazolidine-3-carbothioamide Traditional Name: 2-[4-(3-hydroxy-3-methyl-but-1-ynyl)phenyl]-N-(p-tolyl)thiazolidine-3-carbothioamide Formula: C22H24N2OS2 MolecularWeight: 396.56876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)N2CCSC2C3=CC=C(C=C3)C#CC(C)(C)O

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)N2CCSC2C3=CC=C(C=C3)C#CC(C)(C)O

InChI

InChI=1S/C22H24N2OS2/c1-16-4-10-19(11-5-16)23-21(26)24-14-15-27-20(24)18-8-6-17(7-9-18)12-13-22(2,3)25/h4-11,20,25H,14-15H2,1-3H3,(H,23,26)