N-tert-butyl-2-[4-(5-chloranyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)piperazin-1-yl]propanamide

Systemtic Name: N-tert-butyl-2-[4-(5-chloranyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)piperazin-1-yl]propanamide Openeye Name: N-tert-butyl-2-[4-(5-chloro-6-oxo-1-phenyl-pyridazin-4-yl)piperazin-1-yl]propanamide CAS Name: N-tert-butyl-2-[4-(5-chloro-6-oxo-1-phenyl-4-pyridazinyl)-1-piperazinyl]propanamide IUPAC Name: N-tert-butyl-2-[4-(5-chloro-6-oxo-1-phenylpyridazin-4-yl)piperazin-1-yl]propanamide Traditional Name: N-tert-butyl-2-[4-(5-chloro-6-keto-1-phenyl-pyridazin-4-yl)piperazino]propionamide Formula: C21H28ClN5O2 MolecularWeight: 417.93232

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28ClN5O2/c1-15(19(28)24-21(2,3)4)25-10-12-26(13-11-25)17-14-23-27(20(29)18(17)22)16-8-6-5-7-9-16/h5-9,14-15H,10-13H2,1-4H3,(H,24,28)