4-(1-methylimidazol-2-yl)sulfanyl-1-thiophen-2-yl-butan-1-one

Systemtic Name: 4-(1-methylimidazol-2-yl)sulfanyl-1-thiophen-2-yl-butan-1-one Openeye Name: 4-(1-methylimidazol-2-yl)sulfanyl-1-(2-thienyl)butan-1-one CAS Name: 4-[(1-methyl-2-imidazolyl)thio]-1-thiophen-2-yl-1-butanone IUPAC Name: 4-(1-methylimidazol-2-yl)sulfanyl-1-thiophen-2-ylbutan-1-one Traditional Name: 4-[(1-methylimidazol-2-yl)thio]-1-(2-thienyl)butan-1-one Formula: C12H14N2OS2 MolecularWeight: 266.38236

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCCCC(=O)C2=CC=CS2

Isomeric SMILES

CN1C=CN=C1SCCCC(=O)C2=CC=CS2

InChI

InChI=1S/C12H14N2OS2/c1-14-7-6-13-12(14)17-9-2-4-10(15)11-5-3-8-16-11/h3,5-8H,2,4,9H2,1H3