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

Systemtic Name: N-(4-ethoxyphenyl)-2-[5-(3-methyl-3-oxidanyl-but-1-ynyl)thiophen-2-yl]-1,3-thiazolidine-3-carbothioamide Openeye Name: N-(4-ethoxyphenyl)-2-[5-(3-hydroxy-3-methyl-but-1-ynyl)-2-thienyl]thiazolidine-3-carbothioamide CAS Name: N-(4-ethoxyphenyl)-2-[5-(3-hydroxy-3-methylbut-1-ynyl)-2-thiophenyl]-3-thiazolidinecarbothioamide IUPAC Name: N-(4-ethoxyphenyl)-2-[5-(3-hydroxy-3-methylbut-1-ynyl)thiophen-2-yl]-1,3-thiazolidine-3-carbothioamide Traditional Name: 2-[5-(3-hydroxy-3-methyl-but-1-ynyl)-2-thienyl]-N-p-phenetyl-thiazolidine-3-carbothioamide Formula: C21H24N2O2S3 MolecularWeight: 432.62246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)N2CCSC2C3=CC=C(S3)C#CC(C)(C)O

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)N2CCSC2C3=CC=C(S3)C#CC(C)(C)O

InChI

InChI=1S/C21H24N2O2S3/c1-4-25-16-7-5-15(6-8-16)22-20(26)23-13-14-27-19(23)18-10-9-17(28-18)11-12-21(2,3)24/h5-10,19,24H,4,13-14H2,1-3H3,(H,22,26)