2-[2-[(2-methyl-6-propan-2-yl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: 2-[2-[(2-methyl-6-propan-2-yl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: 2-[2-(2-isopropyl-6-methyl-anilino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]thio]acetate IUPAC Name: 2-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-(2-isopropyl-6-methyl-anilino)-2-keto-ethyl]thio]acetate Formula: C14H18NO3S- MolecularWeight: 280.36262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)NC(=O)CSCC(=O)[O-]

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)NC(=O)CSCC(=O)[O-]

InChI

InChI=1S/C14H19NO3S/c1-9(2)11-6-4-5-10(3)14(11)15-12(16)7-19-8-13(17)18/h4-6,9H,7-8H2,1-3H3,(H,15,16)(H,17,18)/p-1