2-[2-[4-(5-chloranyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)piperazin-1-yl]ethanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[2-[4-(5-chloranyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)piperazin-1-yl]ethanoylamino]thiophene-3-carboxamide Openeye Name: 2-[[2-[4-(5-chloro-6-oxo-1-phenyl-pyridazin-4-yl)piperazin-1-yl]acetyl]amino]thiophene-3-carboxamide CAS Name: 2-[[2-[4-(5-chloro-6-oxo-1-phenyl-4-pyridazinyl)-1-piperazinyl]-1-oxoethyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[[2-[4-(5-chloro-6-oxo-1-phenylpyridazin-4-yl)piperazin-1-yl]acetyl]amino]thiophene-3-carboxamide Traditional Name: 2-[[2-[4-(5-chloro-6-keto-1-phenyl-pyridazin-4-yl)piperazino]acetyl]amino]thiophene-3-carboxamide Formula: C21H21ClN6O3S MolecularWeight: 472.94784

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NC2=C(C=CS2)C(=O)N)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)Cl

Isomeric SMILES

C1CN(CCN1CC(=O)NC2=C(C=CS2)C(=O)N)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C21H21ClN6O3S/c22-18-16(12-24-28(21(18)31)14-4-2-1-3-5-14)27-9-7-26(8-10-27)13-17(29)25-20-15(19(23)30)6-11-32-20/h1-6,11-12H,7-10,13H2,(H2,23,30)(H,25,29)