tert-butyl 4-[[4-[(3-chlorophenyl)carbamoyl]-1H-imidazol-5-yl]carbonyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[[4-[(3-chlorophenyl)carbamoyl]-1H-imidazol-5-yl]carbonyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-[(3-chlorophenyl)carbamoyl]-1H-imidazole-5-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[4-[(3-chloroanilino)-oxomethyl]-1H-imidazol-5-yl]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[(3-chlorophenyl)carbamoyl]-1H-imidazole-5-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[4-[(3-chlorophenyl)carbamoyl]-1H-imidazole-5-carbonyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C20H24ClN5O4 MolecularWeight: 433.88866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=C(N=CN2)C(=O)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=C(N=CN2)C(=O)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H24ClN5O4/c1-20(2,3)30-19(29)26-9-7-25(8-10-26)18(28)16-15(22-12-23-16)17(27)24-14-6-4-5-13(21)11-14/h4-6,11-12H,7-10H2,1-3H3,(H,22,23)(H,24,27)