N-(4-chloranyl-3-nitro-phenyl)-2-[(4-methyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-chloranyl-3-nitro-phenyl)-2-[(4-methyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(4-chloro-3-nitro-phenyl)-2-[[4-methyl-5-(2-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(4-chloro-3-nitrophenyl)-2-[[4-methyl-5-(2-pyridinyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(4-chloro-3-nitrophenyl)-2-[(4-methyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(4-chloro-3-nitro-phenyl)-2-[[4-methyl-5-(2-pyridyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C16H13ClN6O3S MolecularWeight: 404.83082

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])C3=CC=CC=N3

Isomeric SMILES

CN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])C3=CC=CC=N3

InChI

InChI=1S/C16H13ClN6O3S/c1-22-15(12-4-2-3-7-18-12)20-21-16(22)27-9-14(24)19-10-5-6-11(17)13(8-10)23(25)26/h2-8H,9H2,1H3,(H,19,24)