2-chloranyl-N-[3-chloranyl-4-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]pyridine-3-carboxamide

Systemtic Name: 2-chloranyl-N-[3-chloranyl-4-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]pyridine-3-carboxamide Openeye Name: 2-chloro-N-[3-chloro-4-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]pyridine-3-carboxamide CAS Name: 2-chloro-N-[3-chloro-4-[4-(2-methyl-1-oxopropyl)-1-piperazinyl]phenyl]-3-pyridinecarboxamide IUPAC Name: 2-chloro-N-[3-chloro-4-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]pyridine-3-carboxamide Traditional Name: 2-chloro-N-[3-chloro-4-(4-isobutyrylpiperazino)phenyl]nicotinamide Formula: C20H22Cl2N4O2 MolecularWeight: 421.32028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=C(N=CC=C3)Cl)Cl

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=C(N=CC=C3)Cl)Cl

InChI

InChI=1S/C20H22Cl2N4O2/c1-13(2)20(28)26-10-8-25(9-11-26)17-6-5-14(12-16(17)21)24-19(27)15-4-3-7-23-18(15)22/h3-7,12-13H,8-11H2,1-2H3,(H,24,27)