(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 2-methyl-5-pyrrolidin-1-ylsulfonyl-benzoate

Systemtic Name: (5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 2-methyl-5-pyrrolidin-1-ylsulfonyl-benzoate Openeye Name: [5-methyl-2-(2-thienyl)oxazol-4-yl]methyl 2-methyl-5-pyrrolidin-1-ylsulfonyl-benzoate CAS Name: 2-methyl-5-(1-pyrrolidinylsulfonyl)benzoic acid (5-methyl-2-thiophen-2-yl-4-oxazolyl)methyl ester IUPAC Name: (5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 2-methyl-5-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 2-methyl-5-pyrrolidinosulfonyl-benzoic acid [5-methyl-2-(2-thienyl)oxazol-4-yl]methyl ester Formula: C21H22N2O5S2 MolecularWeight: 446.53978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)OCC3=C(OC(=N3)C4=CC=CS4)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)OCC3=C(OC(=N3)C4=CC=CS4)C

InChI

InChI=1S/C21H22N2O5S2/c1-14-7-8-16(30(25,26)23-9-3-4-10-23)12-17(14)21(24)27-13-18-15(2)28-20(22-18)19-6-5-11-29-19/h5-8,11-12H,3-4,9-10,13H2,1-2H3