2-[2-[methyl-[(1S)-1-phenylethyl]amino]-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: 2-[2-[methyl-[(1S)-1-phenylethyl]amino]-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: 2-[2-[methyl-[(1S)-1-phenylethyl]amino]-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-[methyl-[(1S)-1-phenylethyl]amino]-2-oxoethyl]thio]benzoate IUPAC Name: 2-[2-[methyl-[(1S)-1-phenylethyl]amino]-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-keto-2-[methyl-[(1S)-1-phenylethyl]amino]ethyl]thio]benzoate Formula: C18H18NO3S- MolecularWeight: 328.40542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N(C)C(=O)CSC2=CC=CC=C2C(=O)[O-]

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)N(C)C(=O)CSC2=CC=CC=C2C(=O)[O-]

InChI

InChI=1S/C18H19NO3S/c1-13(14-8-4-3-5-9-14)19(2)17(20)12-23-16-11-7-6-10-15(16)18(21)22/h3-11,13H,12H2,1-2H3,(H,21,22)/p-1/t13-/m0/s1