3-[4-[4-(4-chloranyl-3-nitro-phenyl)-1,3-thiazol-2-yl]piperidin-1-yl]carbonyl-1H-pyridazin-6-one

Systemtic Name: 3-[4-[4-(4-chloranyl-3-nitro-phenyl)-1,3-thiazol-2-yl]piperidin-1-yl]carbonyl-1H-pyridazin-6-one Openeye Name: 3-[4-[4-(4-chloro-3-nitro-phenyl)thiazol-2-yl]piperidine-1-carbonyl]-1H-pyridazin-6-one CAS Name: 3-[[4-[4-(4-chloro-3-nitrophenyl)-2-thiazolyl]-1-piperidinyl]-oxomethyl]-1H-pyridazin-6-one IUPAC Name: 3-[4-[4-(4-chloro-3-nitrophenyl)-1,3-thiazol-2-yl]piperidine-1-carbonyl]-1H-pyridazin-6-one Traditional Name: 3-[4-[4-(4-chloro-3-nitro-phenyl)thiazol-2-yl]piperidine-1-carbonyl]-1H-pyridazin-6-one Formula: C19H16ClN5O4S MolecularWeight: 445.87944

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC(=CS2)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)C4=NNC(=O)C=C4

Isomeric SMILES

C1CN(CCC1C2=NC(=CS2)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)C4=NNC(=O)C=C4

InChI

InChI=1S/C19H16ClN5O4S/c20-13-2-1-12(9-16(13)25(28)29)15-10-30-18(21-15)11-5-7-24(8-6-11)19(27)14-3-4-17(26)23-22-14/h1-4,9-11H,5-8H2,(H,23,26)