(1-ethoxycarbothioylsulfanyl-4-oxidanylidene-4-thiophen-2-yl-butyl) 2,2-dimethylpropanoate

Systemtic Name: (1-ethoxycarbothioylsulfanyl-4-oxidanylidene-4-thiophen-2-yl-butyl) 2,2-dimethylpropanoate Openeye Name: [1-ethoxycarbothioylsulfanyl-4-oxo-4-(2-thienyl)butyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [1-[[ethoxy(sulfanylidene)methyl]thio]-4-oxo-4-thiophen-2-ylbutyl] ester IUPAC Name: (1-ethoxycarbothioylsulfanyl-4-oxo-4-thiophen-2-ylbutyl) 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [1-(ethoxycarbothioylthio)-4-keto-4-(2-thienyl)butyl] ester Formula: C16H22O4S3 MolecularWeight: 374.53848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=S)SC(CCC(=O)C1=CC=CS1)OC(=O)C(C)(C)C

Isomeric SMILES

CCOC(=S)SC(CCC(=O)C1=CC=CS1)OC(=O)C(C)(C)C

InChI

InChI=1S/C16H22O4S3/c1-5-19-15(21)23-13(20-14(18)16(2,3)4)9-8-11(17)12-7-6-10-22-12/h6-7,10,13H,5,8-9H2,1-4H3