1-(1-methyl-4,5-dipropyl-imidazol-2-yl)sulfanylpropan-2-one

Systemtic Name: 1-(1-methyl-4,5-dipropyl-imidazol-2-yl)sulfanylpropan-2-one Openeye Name: 1-(1-methyl-4,5-dipropyl-imidazol-2-yl)sulfanylpropan-2-one CAS Name: 1-[(1-methyl-4,5-dipropyl-2-imidazolyl)thio]-2-propanone IUPAC Name: 1-(1-methyl-4,5-dipropylimidazol-2-yl)sulfanylpropan-2-one Traditional Name: 1-[(1-methyl-4,5-dipropyl-imidazol-2-yl)thio]acetone Formula: C13H22N2OS MolecularWeight: 254.39158

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N(C(=N1)SCC(=O)C)C)CCC

Isomeric SMILES

CCCC1=C(N(C(=N1)SCC(=O)C)C)CCC

InChI

InChI=1S/C13H22N2OS/c1-5-7-11-12(8-6-2)15(4)13(14-11)17-9-10(3)16/h5-9H2,1-4H3