[3-oxidanylidene-3-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]propyl] 4-methylsulfanylbenzoate

Systemtic Name: [3-oxidanylidene-3-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]propyl] 4-methylsulfanylbenzoate Openeye Name: [3-oxo-3-[4-(2-oxopyrrolidin-1-yl)anilino]propyl] 4-methylsulfanylbenzoate CAS Name: 4-(methylthio)benzoic acid [3-oxo-3-[4-(2-oxo-1-pyrrolidinyl)anilino]propyl] ester IUPAC Name: [3-oxo-3-[4-(2-oxopyrrolidin-1-yl)anilino]propyl] 4-methylsulfanylbenzoate Traditional Name: 4-(methylthio)benzoic acid [3-keto-3-[4-(2-ketopyrrolidino)anilino]propyl] ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)OCCC(=O)NC2=CC=C(C=C2)N3CCCC3=O

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)OCCC(=O)NC2=CC=C(C=C2)N3CCCC3=O

InChI

InChI=1S/C21H22N2O4S/c1-28-18-10-4-15(5-11-18)21(26)27-14-12-19(24)22-16-6-8-17(9-7-16)23-13-2-3-20(23)25/h4-11H,2-3,12-14H2,1H3,(H,22,24)