N-(tert-butylcarbamoyl)-3-[4-(5-chloranyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)piperazin-1-yl]propanamide

Systemtic Name: N-(tert-butylcarbamoyl)-3-[4-(5-chloranyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)piperazin-1-yl]propanamide Openeye Name: N-(tert-butylcarbamoyl)-3-[4-(5-chloro-6-oxo-1-phenyl-pyridazin-4-yl)piperazin-1-yl]propanamide CAS Name: N-[(tert-butylamino)-oxomethyl]-3-[4-(5-chloro-6-oxo-1-phenyl-4-pyridazinyl)-1-piperazinyl]propanamide IUPAC Name: N-(tert-butylcarbamoyl)-3-[4-(5-chloro-6-oxo-1-phenylpyridazin-4-yl)piperazin-1-yl]propanamide Traditional Name: N-(tert-butylcarbamoyl)-3-[4-(5-chloro-6-keto-1-phenyl-pyridazin-4-yl)piperazino]propionamide Formula: C22H29ClN6O3 MolecularWeight: 460.95706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NC(=O)CCN1CCN(CC1)C2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl

Isomeric SMILES

CC(C)(C)NC(=O)NC(=O)CCN1CCN(CC1)C2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl

InChI

InChI=1S/C22H29ClN6O3/c1-22(2,3)26-21(32)25-18(30)9-10-27-11-13-28(14-12-27)17-15-24-29(20(31)19(17)23)16-7-5-4-6-8-16/h4-8,15H,9-14H2,1-3H3,(H2,25,26,30,32)