phenyl 2-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]-4-oxidanyl-pyrrolidine-1-carboxylate

Systemtic Name: phenyl 2-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]-4-oxidanyl-pyrrolidine-1-carboxylate Openeye Name: phenyl 4-hydroxy-2-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]pyrrolidine-1-carboxylate CAS Name: 4-hydroxy-2-[[(6-methyl-1,3-benzothiazol-2-yl)amino]-oxomethyl]-1-pyrrolidinecarboxylic acid phenyl ester IUPAC Name: phenyl 4-hydroxy-2-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]pyrrolidine-1-carboxylate Traditional Name: 4-hydroxy-2-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]pyrrolidine-1-carboxylic acid phenyl ester Formula: C20H19N3O4S MolecularWeight: 397.44756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CC(CN3C(=O)OC4=CC=CC=C4)O

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CC(CN3C(=O)OC4=CC=CC=C4)O

InChI

InChI=1S/C20H19N3O4S/c1-12-7-8-15-17(9-12)28-19(21-15)22-18(25)16-10-13(24)11-23(16)20(26)27-14-5-3-2-4-6-14/h2-9,13,16,24H,10-11H2,1H3,(H,21,22,25)