[2-(cyclopentylamino)-2-oxidanylidene-ethyl] 2-[[(2S)-oxolan-2-yl]methylsulfanyl]benzoate

Systemtic Name: [2-(cyclopentylamino)-2-oxidanylidene-ethyl] 2-[[(2S)-oxolan-2-yl]methylsulfanyl]benzoate Openeye Name: [2-(cyclopentylamino)-2-oxo-ethyl] 2-[[(2S)-tetrahydrofuran-2-yl]methylsulfanyl]benzoate CAS Name: 2-[[(2S)-2-oxolanyl]methylthio]benzoic acid [2-(cyclopentylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclopentylamino)-2-oxoethyl] 2-[[(2S)-oxolan-2-yl]methylsulfanyl]benzoate Traditional Name: 2-[[(2S)-tetrahydrofuran-2-yl]methylthio]benzoic acid [2-(cyclopentylamino)-2-keto-ethyl] ester Formula: C19H25NO4S MolecularWeight: 363.4711

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)COC(=O)C2=CC=CC=C2SCC3CCCO3

Isomeric SMILES

C1CCC(C1)NC(=O)COC(=O)C2=CC=CC=C2SC[C@@H]3CCCO3

InChI

InChI=1S/C19H25NO4S/c21-18(20-14-6-1-2-7-14)12-24-19(22)16-9-3-4-10-17(16)25-13-15-8-5-11-23-15/h3-4,9-10,14-15H,1-2,5-8,11-13H2,(H,20,21)/t15-/m0/s1