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

Systemtic Name: N-(4-ethoxyphenyl)-2-[4-(3-methyl-3-oxidanyl-but-1-ynyl)phenyl]-1,3-thiazolidine-3-carbothioamide Openeye Name: N-(4-ethoxyphenyl)-2-[4-(3-hydroxy-3-methyl-but-1-ynyl)phenyl]thiazolidine-3-carbothioamide CAS Name: N-(4-ethoxyphenyl)-2-[4-(3-hydroxy-3-methylbut-1-ynyl)phenyl]-3-thiazolidinecarbothioamide IUPAC Name: N-(4-ethoxyphenyl)-2-[4-(3-hydroxy-3-methylbut-1-ynyl)phenyl]-1,3-thiazolidine-3-carbothioamide Traditional Name: 2-[4-(3-hydroxy-3-methyl-but-1-ynyl)phenyl]-N-p-phenetyl-thiazolidine-3-carbothioamide Formula: C23H26N2O2S2 MolecularWeight: 426.59474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)N2CCSC2C3=CC=C(C=C3)C#CC(C)(C)O

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)N2CCSC2C3=CC=C(C=C3)C#CC(C)(C)O

InChI

InChI=1S/C23H26N2O2S2/c1-4-27-20-11-9-19(10-12-20)24-22(28)25-15-16-29-21(25)18-7-5-17(6-8-18)13-14-23(2,3)26/h5-12,21,26H,4,15-16H2,1-3H3,(H,24,28)