N-(3-chloranyl-2-methyl-phenyl)-2-[6-(3-nitrophenyl)pyridazin-3-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-[6-(3-nitrophenyl)pyridazin-3-yl]sulfanyl-ethanamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-2-[6-(3-nitrophenyl)pyridazin-3-yl]sulfanyl-acetamide CAS Name: N-(3-chloro-2-methylphenyl)-2-[[6-(3-nitrophenyl)-3-pyridazinyl]thio]acetamide IUPAC Name: N-(3-chloro-2-methylphenyl)-2-[6-(3-nitrophenyl)pyridazin-3-yl]sulfanylacetamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-2-[[6-(3-nitrophenyl)pyridazin-3-yl]thio]acetamide Formula: C19H15ClN4O3S MolecularWeight: 414.8654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)CSC2=NN=C(C=C2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)CSC2=NN=C(C=C2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H15ClN4O3S/c1-12-15(20)6-3-7-16(12)21-18(25)11-28-19-9-8-17(22-23-19)13-4-2-5-14(10-13)24(26)27/h2-10H,11H2,1H3,(H,21,25)