methyl 2-[1-methyl-4-oxidanylidene-5-(phenylmethylidene)imidazol-2-yl]sulfanylethanoate

Systemtic Name: methyl 2-[1-methyl-4-oxidanylidene-5-(phenylmethylidene)imidazol-2-yl]sulfanylethanoate Openeye Name: methyl 2-(5-benzylidene-1-methyl-4-oxo-imidazol-2-yl)sulfanylacetate CAS Name: 2-[[1-methyl-4-oxo-5-(phenylmethylene)-2-imidazolyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-(5-benzylidene-1-methyl-4-oxoimidazol-2-yl)sulfanylacetate Traditional Name: 2-[(5-benzal-4-keto-1-methyl-2-imidazolin-2-yl)thio]acetic acid methyl ester Formula: C14H14N2O3S MolecularWeight: 290.33756

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC2=CC=CC=C2)C(=O)N=C1SCC(=O)OC

Isomeric SMILES

CN1C(=CC2=CC=CC=C2)C(=O)N=C1SCC(=O)OC

InChI

InChI=1S/C14H14N2O3S/c1-16-11(8-10-6-4-3-5-7-10)13(18)15-14(16)20-9-12(17)19-2/h3-8H,9H2,1-2H3