[(2S)-1-(cyclopentylamino)-1-oxidanylidene-propan-2-yl] 2-(furan-2-ylmethylsulfanyl)benzoate

Systemtic Name: [(2S)-1-(cyclopentylamino)-1-oxidanylidene-propan-2-yl] 2-(furan-2-ylmethylsulfanyl)benzoate Openeye Name: [(1S)-2-(cyclopentylamino)-1-methyl-2-oxo-ethyl] 2-(2-furylmethylsulfanyl)benzoate CAS Name: 2-(2-furanylmethylthio)benzoic acid [(2S)-1-(cyclopentylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(cyclopentylamino)-1-oxopropan-2-yl] 2-(furan-2-ylmethylsulfanyl)benzoate Traditional Name: 2-(2-furfurylthio)benzoic acid [(1S)-2-(cyclopentylamino)-2-keto-1-methyl-ethyl] ester Formula: C20H23NO4S MolecularWeight: 373.46592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCC1)OC(=O)C2=CC=CC=C2SCC3=CC=CO3

Isomeric SMILES

C[C@@H](C(=O)NC1CCCC1)OC(=O)C2=CC=CC=C2SCC3=CC=CO3

InChI

InChI=1S/C20H23NO4S/c1-14(19(22)21-15-7-2-3-8-15)25-20(23)17-10-4-5-11-18(17)26-13-16-9-6-12-24-16/h4-6,9-12,14-15H,2-3,7-8,13H2,1H3,(H,21,22)/t14-/m0/s1