tert-butyl 4-[[4-chloranyl-2-[(5-methylpyridin-2-yl)carbamoyl]phenyl]carbamoyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[[4-chloranyl-2-[(5-methylpyridin-2-yl)carbamoyl]phenyl]carbamoyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[[4-chloro-2-[(5-methyl-2-pyridyl)carbamoyl]phenyl]carbamoyl]piperazine-1-carboxylate CAS Name: 4-[[4-chloro-2-[[(5-methyl-2-pyridinyl)amino]-oxomethyl]anilino]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[4-chloro-2-[(5-methylpyridin-2-yl)carbamoyl]phenyl]carbamoyl]piperazine-1-carboxylate Traditional Name: 4-[[4-chloro-2-[(5-methyl-2-pyridyl)carbamoyl]phenyl]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)NC(=O)C2=C(C=CC(=C2)Cl)NC(=O)N3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

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

InChI

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