(2-phenyl-1,3-thiazol-5-yl)methyl 4-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: (2-phenyl-1,3-thiazol-5-yl)methyl 4-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: (2-phenylthiazol-5-yl)methyl 4-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 4-(1-pyrrolidinylsulfonyl)benzoic acid (2-phenyl-5-thiazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-thiazol-5-yl)methyl 4-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-pyrrolidinosulfonylbenzoic acid (2-phenylthiazol-5-yl)methyl ester Formula: C21H20N2O4S2 MolecularWeight: 428.5245

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=CN=C(S3)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=CN=C(S3)C4=CC=CC=C4

InChI

InChI=1S/C21H20N2O4S2/c24-21(27-15-18-14-22-20(28-18)16-6-2-1-3-7-16)17-8-10-19(11-9-17)29(25,26)23-12-4-5-13-23/h1-3,6-11,14H,4-5,12-13,15H2