(4-pyrrolidin-1-ylcarbonylphenyl)methyl 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)benzoate

Systemtic Name: (4-pyrrolidin-1-ylcarbonylphenyl)methyl 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)benzoate Openeye Name: [4-(pyrrolidine-1-carbonyl)phenyl]methyl 2-(4,5-dihydrothiazol-2-ylsulfanylmethyl)benzoate CAS Name: 2-[(4,5-dihydrothiazol-2-ylthio)methyl]benzoic acid [4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl ester IUPAC Name: [4-(pyrrolidine-1-carbonyl)phenyl]methyl 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)benzoate Traditional Name: 2-[(2-thiazolin-2-ylthio)methyl]benzoic acid [4-(pyrrolidine-1-carbonyl)benzyl] ester Formula: C23H24N2O3S2 MolecularWeight: 440.57826

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=C(C=C2)COC(=O)C3=CC=CC=C3CSC4=NCCS4

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=C(C=C2)COC(=O)C3=CC=CC=C3CSC4=NCCS4

InChI

InChI=1S/C23H24N2O3S2/c26-21(25-12-3-4-13-25)18-9-7-17(8-10-18)15-28-22(27)20-6-2-1-5-19(20)16-30-23-24-11-14-29-23/h1-2,5-10H,3-4,11-16H2