[(2S)-1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 2-(4-methoxyphenyl)sulfanylethanoate

Systemtic Name: [(2S)-1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 2-(4-methoxyphenyl)sulfanylethanoate Openeye Name: [(1S)-2-(isobutylamino)-1-methyl-2-oxo-ethyl] 2-(4-methoxyphenyl)sulfanylacetate CAS Name: 2-[(4-methoxyphenyl)thio]acetic acid [(2S)-1-(2-methylpropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(2-methylpropylamino)-1-oxopropan-2-yl] 2-(4-methoxyphenyl)sulfanylacetate Traditional Name: 2-[(4-methoxyphenyl)thio]acetic acid [(1S)-2-(isobutylamino)-2-keto-1-methyl-ethyl] ester Formula: C16H23NO4S MolecularWeight: 325.42312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C(C)OC(=O)CSC1=CC=C(C=C1)OC

Isomeric SMILES

C[C@@H](C(=O)NCC(C)C)OC(=O)CSC1=CC=C(C=C1)OC

InChI

InChI=1S/C16H23NO4S/c1-11(2)9-17-16(19)12(3)21-15(18)10-22-14-7-5-13(20-4)6-8-14/h5-8,11-12H,9-10H2,1-4H3,(H,17,19)/t12-/m0/s1