(Z)-1-(5-methylimidazol-1-yl)-3-(phenylmethylsulfanyl)prop-2-en-1-one

Systemtic Name: (Z)-1-(5-methylimidazol-1-yl)-3-(phenylmethylsulfanyl)prop-2-en-1-one Openeye Name: (Z)-3-benzylsulfanyl-1-(5-methylimidazol-1-yl)prop-2-en-1-one CAS Name: (Z)-1-(5-methyl-1-imidazolyl)-3-(phenylmethylthio)-2-propen-1-one IUPAC Name: (Z)-3-benzylsulfanyl-1-(5-methylimidazol-1-yl)prop-2-en-1-one Traditional Name: (Z)-3-(benzylthio)-1-(5-methylimidazol-1-yl)prop-2-en-1-one Formula: C14H14N2OS MolecularWeight: 258.33876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=CN1C(=O)C=CSCC2=CC=CC=C2

Isomeric SMILES

CC1=CN=CN1C(=O)/C=C\SCC2=CC=CC=C2

InChI

InChI=1S/C14H14N2OS/c1-12-9-15-11-16(12)14(17)7-8-18-10-13-5-3-2-4-6-13/h2-9,11H,10H2,1H3/b8-7-