2-[6-(3-nitrophenyl)pyridazin-3-yl]sulfanyl-N-phenethyl-ethanamide

Systemtic Name: 2-[6-(3-nitrophenyl)pyridazin-3-yl]sulfanyl-N-phenethyl-ethanamide Openeye Name: 2-[6-(3-nitrophenyl)pyridazin-3-yl]sulfanyl-N-phenethyl-acetamide CAS Name: 2-[[6-(3-nitrophenyl)-3-pyridazinyl]thio]-N-phenethylacetamide IUPAC Name: 2-[6-(3-nitrophenyl)pyridazin-3-yl]sulfanyl-N-phenethylacetamide Traditional Name: 2-[[6-(3-nitrophenyl)pyridazin-3-yl]thio]-N-phenethyl-acetamide Formula: C20H18N4O3S MolecularWeight: 394.44692

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CSC2=NN=C(C=C2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CSC2=NN=C(C=C2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O3S/c25-19(21-12-11-15-5-2-1-3-6-15)14-28-20-10-9-18(22-23-20)16-7-4-8-17(13-16)24(26)27/h1-10,13H,11-12,14H2,(H,21,25)