4-[4-(5-chloranyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)piperazin-1-yl]-3-nitro-N-propan-2-yl-benzamide

Systemtic Name: 4-[4-(5-chloranyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)piperazin-1-yl]-3-nitro-N-propan-2-yl-benzamide Openeye Name: 4-[4-(5-chloro-6-oxo-1-phenyl-pyridazin-4-yl)piperazin-1-yl]-N-isopropyl-3-nitro-benzamide CAS Name: 4-[4-(5-chloro-6-oxo-1-phenyl-4-pyridazinyl)-1-piperazinyl]-3-nitro-N-propan-2-ylbenzamide IUPAC Name: 4-[4-(5-chloro-6-oxo-1-phenylpyridazin-4-yl)piperazin-1-yl]-3-nitro-N-propan-2-ylbenzamide Traditional Name: 4-[4-(5-chloro-6-keto-1-phenyl-pyridazin-4-yl)piperazino]-N-isopropyl-3-nitro-benzamide Formula: C24H25ClN6O4 MolecularWeight: 496.9461

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)NC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C24H25ClN6O4/c1-16(2)27-23(32)17-8-9-19(20(14-17)31(34)35)28-10-12-29(13-11-28)21-15-26-30(24(33)22(21)25)18-6-4-3-5-7-18/h3-9,14-16H,10-13H2,1-2H3,(H,27,32)