(phenylmethyl) 2-[[4-azanyl-2-[(4-sulfamoylphenyl)amino]-1,3-thiazol-5-yl]carbonyl]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-[[4-azanyl-2-[(4-sulfamoylphenyl)amino]-1,3-thiazol-5-yl]carbonyl]pyrrolidine-1-carboxylate Openeye Name: benzyl 2-[4-amino-2-(4-sulfamoylanilino)thiazole-5-carbonyl]pyrrolidine-1-carboxylate CAS Name: 2-[[4-amino-2-(4-sulfamoylanilino)-5-thiazolyl]-oxomethyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[4-amino-2-(4-sulfamoylanilino)-1,3-thiazole-5-carbonyl]pyrrolidine-1-carboxylate Traditional Name: 2-[4-amino-2-(4-sulfamoylanilino)thiazole-5-carbonyl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C22H23N5O5S2 MolecularWeight: 501.57852

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)C3=C(N=C(S3)NC4=CC=C(C=C4)S(=O)(=O)N)N

Isomeric SMILES

C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)C3=C(N=C(S3)NC4=CC=C(C=C4)S(=O)(=O)N)N

InChI

InChI=1S/C22H23N5O5S2/c23-20-19(33-21(26-20)25-15-8-10-16(11-9-15)34(24,30)31)18(28)17-7-4-12-27(17)22(29)32-13-14-5-2-1-3-6-14/h1-3,5-6,8-11,17H,4,7,12-13,23H2,(H,25,26)(H2,24,30,31)