tert-butyl 4-[[2-(4-chlorophenyl)-1,3-thiazol-4-yl]carbonyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[[2-(4-chlorophenyl)-1,3-thiazol-4-yl]carbonyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-(4-chlorophenyl)thiazole-4-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[2-(4-chlorophenyl)-4-thiazolyl]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(4-chlorophenyl)-1,3-thiazole-4-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[2-(4-chlorophenyl)thiazole-4-carbonyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C19H22ClN3O3S MolecularWeight: 407.91428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CSC(=N2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CSC(=N2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H22ClN3O3S/c1-19(2,3)26-18(25)23-10-8-22(9-11-23)17(24)15-12-27-16(21-15)13-4-6-14(20)7-5-13/h4-7,12H,8-11H2,1-3H3