(E)-4-(2-sulfanyl-3H-1,3-thiazol-2-yl)but-3-en-2-one

Systemtic Name: (E)-4-(2-sulfanyl-3H-1,3-thiazol-2-yl)but-3-en-2-one Openeye Name: (E)-4-(2-sulfanyl-3H-thiazol-2-yl)but-3-en-2-one CAS Name: (E)-4-(2-mercapto-3H-thiazol-2-yl)-3-buten-2-one IUPAC Name: (E)-4-(2-sulfanyl-3H-1,3-thiazol-2-yl)but-3-en-2-one Traditional Name: (E)-4-(2-mercapto-4-thiazolin-2-yl)but-3-en-2-one Formula: C7H9NOS2 MolecularWeight: 187.28246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C=CC1(NC=CS1)S

Isomeric SMILES

CC(=O)/C=C/C1(NC=CS1)S

InChI

InChI=1S/C7H9NOS2/c1-6(9)2-3-7(10)8-4-5-11-7/h2-5,8,10H,1H3/b3-2+