tert-butyl 4-[[(3-chlorophenyl)carbonyl-(5-methylpyridin-2-yl)amino]carbamoyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[[(3-chlorophenyl)carbonyl-(5-methylpyridin-2-yl)amino]carbamoyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[[(3-chlorobenzoyl)-(5-methyl-2-pyridyl)amino]carbamoyl]piperazine-1-carboxylate CAS Name: 4-[[2-[(3-chlorophenyl)-oxomethyl]-2-(5-methyl-2-pyridinyl)hydrazinyl]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[(3-chlorobenzoyl)-(5-methylpyridin-2-yl)amino]carbamoyl]piperazine-1-carboxylate Traditional Name: 4-[[(3-chlorobenzoyl)-(5-methyl-2-pyridyl)amino]carbamoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C23H28ClN5O4 MolecularWeight: 473.95252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)N(C(=O)C2=CC(=CC=C2)Cl)NC(=O)N3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CN=C(C=C1)N(C(=O)C2=CC(=CC=C2)Cl)NC(=O)N3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C23H28ClN5O4/c1-16-8-9-19(25-15-16)29(20(30)17-6-5-7-18(24)14-17)26-21(31)27-10-12-28(13-11-27)22(32)33-23(2,3)4/h5-9,14-15H,10-13H2,1-4H3,(H,26,31)