3-[4-(5-chloranyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)piperazin-1-yl]-N-(3-cyanothiophen-2-yl)propanamide

Systemtic Name: 3-[4-(5-chloranyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)piperazin-1-yl]-N-(3-cyanothiophen-2-yl)propanamide Openeye Name: 3-[4-(5-chloro-6-oxo-1-phenyl-pyridazin-4-yl)piperazin-1-yl]-N-(3-cyano-2-thienyl)propanamide CAS Name: 3-[4-(5-chloro-6-oxo-1-phenyl-4-pyridazinyl)-1-piperazinyl]-N-(3-cyano-2-thiophenyl)propanamide IUPAC Name: 3-[4-(5-chloro-6-oxo-1-phenylpyridazin-4-yl)piperazin-1-yl]-N-(3-cyanothiophen-2-yl)propanamide Traditional Name: 3-[4-(5-chloro-6-keto-1-phenyl-pyridazin-4-yl)piperazino]-N-(3-cyano-2-thienyl)propionamide Formula: C22H21ClN6O2S MolecularWeight: 468.95914

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)NC2=C(C=CS2)C#N)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)Cl

Isomeric SMILES

C1CN(CCN1CCC(=O)NC2=C(C=CS2)C#N)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C22H21ClN6O2S/c23-20-18(15-25-29(22(20)31)17-4-2-1-3-5-17)28-11-9-27(10-12-28)8-6-19(30)26-21-16(14-24)7-13-32-21/h1-5,7,13,15H,6,8-12H2,(H,26,30)