(5-chloranyl-1-methyl-imidazol-2-yl)methyl 5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-benzoate

Systemtic Name: (5-chloranyl-1-methyl-imidazol-2-yl)methyl 5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-benzoate Openeye Name: (5-chloro-1-methyl-imidazol-2-yl)methyl 5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-benzoate CAS Name: 5-(diethylsulfamoyl)-2-(1-pyrrolidinyl)benzoic acid (5-chloro-1-methyl-2-imidazolyl)methyl ester IUPAC Name: (5-chloro-1-methylimidazol-2-yl)methyl 5-(diethylsulfamoyl)-2-pyrrolidin-1-ylbenzoate Traditional Name: 5-(diethylsulfamoyl)-2-pyrrolidino-benzoic acid (5-chloro-1-methyl-imidazol-2-yl)methyl ester Formula: C20H27ClN4O4S MolecularWeight: 454.97078

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)OCC3=NC=C(N3C)Cl

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)OCC3=NC=C(N3C)Cl

InChI

InChI=1S/C20H27ClN4O4S/c1-4-25(5-2)30(27,28)15-8-9-17(24-10-6-7-11-24)16(12-15)20(26)29-14-19-22-13-18(21)23(19)3/h8-9,12-13H,4-7,10-11,14H2,1-3H3