tert-butyl 2-[[4-(2-azanyl-1,3-thiazol-4-yl)phenyl]carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-[[4-(2-azanyl-1,3-thiazol-4-yl)phenyl]carbamoyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-[[4-(2-aminothiazol-4-yl)phenyl]carbamoyl]pyrrolidine-1-carboxylate CAS Name: 2-[[4-(2-amino-4-thiazolyl)anilino]-oxomethyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[4-(2-amino-1,3-thiazol-4-yl)phenyl]carbamoyl]pyrrolidine-1-carboxylate Traditional Name: 2-[[4-(2-aminothiazol-4-yl)phenyl]carbamoyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C19H24N4O3S MolecularWeight: 388.48386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C(=O)NC2=CC=C(C=C2)C3=CSC(=N3)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC1C(=O)NC2=CC=C(C=C2)C3=CSC(=N3)N

InChI

InChI=1S/C19H24N4O3S/c1-19(2,3)26-18(25)23-10-4-5-15(23)16(24)21-13-8-6-12(7-9-13)14-11-27-17(20)22-14/h6-9,11,15H,4-5,10H2,1-3H3,(H2,20,22)(H,21,24)