propyl 3,5-bis(methylsulfanyl)-1,2-thiazole-4-carboxylate

Systemtic Name: propyl 3,5-bis(methylsulfanyl)-1,2-thiazole-4-carboxylate Openeye Name: propyl 3,5-bis(methylsulfanyl)isothiazole-4-carboxylate CAS Name: 3,5-bis(methylthio)-4-isothiazolecarboxylic acid propyl ester IUPAC Name: propyl 3,5-bis(methylsulfanyl)-1,2-thiazole-4-carboxylate Traditional Name: 3,5-bis(methylthio)isothiazole-4-carboxylic acid propyl ester Formula: C9H13NO2S3 MolecularWeight: 263.40002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(SN=C1SC)SC

Isomeric SMILES

CCCOC(=O)C1=C(SN=C1SC)SC

InChI

InChI=1S/C9H13NO2S3/c1-4-5-12-8(11)6-7(13-2)10-15-9(6)14-3/h4-5H2,1-3H3