(1-cyanoindolizin-2-yl)methyl 5-(cyclopropylsulfamoyl)-2-methyl-benzoate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 5-(cyclopropylsulfamoyl)-2-methyl-benzoate Openeye Name: (1-cyanoindolizin-2-yl)methyl 5-(cyclopropylsulfamoyl)-2-methyl-benzoate CAS Name: 5-(cyclopropylsulfamoyl)-2-methylbenzoic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 5-(cyclopropylsulfamoyl)-2-methylbenzoate Traditional Name: 5-(cyclopropylsulfamoyl)-2-methyl-benzoic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C21H19N3O4S MolecularWeight: 409.45826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2CC2)C(=O)OCC3=CN4C=CC=CC4=C3C#N

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2CC2)C(=O)OCC3=CN4C=CC=CC4=C3C#N

InChI

InChI=1S/C21H19N3O4S/c1-14-5-8-17(29(26,27)23-16-6-7-16)10-18(14)21(25)28-13-15-12-24-9-3-2-4-20(24)19(15)11-22/h2-5,8-10,12,16,23H,6-7,13H2,1H3