2-[2-[[(1S)-2-methyl-1-thiophen-2-yl-propyl]amino]-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: 2-[2-[[(1S)-2-methyl-1-thiophen-2-yl-propyl]amino]-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: 2-[2-[[(1S)-2-methyl-1-(2-thienyl)propyl]amino]-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-[[(1S)-2-methyl-1-thiophen-2-ylpropyl]amino]-2-oxoethyl]thio]benzoate IUPAC Name: 2-[2-[[(1S)-2-methyl-1-thiophen-2-ylpropyl]amino]-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-keto-2-[[(1S)-2-methyl-1-(2-thienyl)propyl]amino]ethyl]thio]benzoate Formula: C17H18NO3S2- MolecularWeight: 348.45972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=CS1)NC(=O)CSC2=CC=CC=C2C(=O)[O-]

Isomeric SMILES

CC(C)[C@@H](C1=CC=CS1)NC(=O)CSC2=CC=CC=C2C(=O)[O-]

InChI

InChI=1S/C17H19NO3S2/c1-11(2)16(14-8-5-9-22-14)18-15(19)10-23-13-7-4-3-6-12(13)17(20)21/h3-9,11,16H,10H2,1-2H3,(H,18,19)(H,20,21)/p-1/t16-/m0/s1