4-(5-chloranyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)-N-(2-thiophen-2-ylethyl)piperazine-1-carboxamide

Systemtic Name: 4-(5-chloranyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)-N-(2-thiophen-2-ylethyl)piperazine-1-carboxamide Openeye Name: 4-(5-chloro-6-oxo-1-phenyl-pyridazin-4-yl)-N-[2-(2-thienyl)ethyl]piperazine-1-carboxamide CAS Name: 4-(5-chloro-6-oxo-1-phenyl-4-pyridazinyl)-N-(2-thiophen-2-ylethyl)-1-piperazinecarboxamide IUPAC Name: 4-(5-chloro-6-oxo-1-phenylpyridazin-4-yl)-N-(2-thiophen-2-ylethyl)piperazine-1-carboxamide Traditional Name: 4-(5-chloro-6-keto-1-phenyl-pyridazin-4-yl)-N-[2-(2-thienyl)ethyl]piperazine-1-carboxamide Formula: C21H22ClN5O2S MolecularWeight: 443.94968

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl)C(=O)NCCC4=CC=CS4

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl)C(=O)NCCC4=CC=CS4

InChI

InChI=1S/C21H22ClN5O2S/c22-19-18(15-24-27(20(19)28)16-5-2-1-3-6-16)25-10-12-26(13-11-25)21(29)23-9-8-17-7-4-14-30-17/h1-7,14-15H,8-13H2,(H,23,29)