1-methyl-2-[(E)-4-(1-methylimidazol-2-yl)sulfanylbut-2-enyl]sulfanyl-imidazole

Systemtic Name: 1-methyl-2-[(E)-4-(1-methylimidazol-2-yl)sulfanylbut-2-enyl]sulfanyl-imidazole Openeye Name: 1-methyl-2-[(E)-4-(1-methylimidazol-2-yl)sulfanylbut-2-enyl]sulfanyl-imidazole CAS Name: 1-methyl-2-[[(E)-4-[(1-methyl-2-imidazolyl)thio]but-2-enyl]thio]imidazole IUPAC Name: 1-methyl-2-[(E)-4-(1-methylimidazol-2-yl)sulfanylbut-2-enyl]sulfanylimidazole Traditional Name: 1-methyl-2-[[(E)-4-[(1-methylimidazol-2-yl)thio]but-2-enyl]thio]imidazole Formula: C12H16N4S2 MolecularWeight: 280.41224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC=CCSC2=NC=CN2C

Isomeric SMILES

CN1C=CN=C1SC/C=C/CSC2=NC=CN2C

InChI

InChI=1S/C12H16N4S2/c1-15-7-5-13-11(15)17-9-3-4-10-18-12-14-6-8-16(12)2/h3-8H,9-10H2,1-2H3/b4-3+