[2-oxidanylidene-2-[(3-propan-2-yl-1,2-oxazol-5-yl)amino]ethyl] 2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanylbenzoate

Systemtic Name: [2-oxidanylidene-2-[(3-propan-2-yl-1,2-oxazol-5-yl)amino]ethyl] 2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanylbenzoate Openeye Name: [2-[(3-isopropylisoxazol-5-yl)amino]-2-oxo-ethyl] 2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanylbenzoate CAS Name: 2-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]benzoic acid [2-oxo-2-[(3-propan-2-yl-5-isoxazolyl)amino]ethyl] ester IUPAC Name: [2-oxo-2-[(3-propan-2-yl-1,2-oxazol-5-yl)amino]ethyl] 2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylbenzoate Traditional Name: 2-[(2-keto-2-pyrrolidino-ethyl)thio]benzoic acid [2-[(3-isopropylisoxazol-5-yl)amino]-2-keto-ethyl] ester Formula: C21H25N3O5S MolecularWeight: 431.5053

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NOC(=C1)NC(=O)COC(=O)C2=CC=CC=C2SCC(=O)N3CCCC3

Isomeric SMILES

CC(C)C1=NOC(=C1)NC(=O)COC(=O)C2=CC=CC=C2SCC(=O)N3CCCC3

InChI

InChI=1S/C21H25N3O5S/c1-14(2)16-11-19(29-23-16)22-18(25)12-28-21(27)15-7-3-4-8-17(15)30-13-20(26)24-9-5-6-10-24/h3-4,7-8,11,14H,5-6,9-10,12-13H2,1-2H3,(H,22,25)