methyl 3-[2-[2-(3,3-dimethyl-2-oxidanylidene-butoxy)carbonylphenyl]sulfanylethanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[2-[2-(3,3-dimethyl-2-oxidanylidene-butoxy)carbonylphenyl]sulfanylethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-[2-(3,3-dimethyl-2-oxo-butoxy)carbonylphenyl]sulfanylacetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-[[2-[(3,3-dimethyl-2-oxobutoxy)-oxomethyl]phenyl]thio]-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-[2-(3,3-dimethyl-2-oxobutoxy)carbonylphenyl]sulfanylacetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-[[2-(2-keto-3,3-dimethyl-butoxy)carbonylphenyl]thio]acetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C24H27NO6S MolecularWeight: 457.53928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CSC2=CC=CC=C2C(=O)OCC(=O)C(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CSC2=CC=CC=C2C(=O)OCC(=O)C(C)(C)C

InChI

InChI=1S/C24H27NO6S/c1-15-10-11-16(22(28)30-5)12-18(15)25-21(27)14-32-19-9-7-6-8-17(19)23(29)31-13-20(26)24(2,3)4/h6-12H,13-14H2,1-5H3,(H,25,27)