N-(4-chloranyl-2-nitro-phenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide

Systemtic Name: N-(4-chloranyl-2-nitro-phenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide Openeye Name: N-(4-chloro-2-nitro-phenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide CAS Name: N-(4-chloro-2-nitrophenyl)-2-(1H-1,2,4-triazol-5-ylthio)acetamide IUPAC Name: N-(4-chloro-2-nitrophenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide Traditional Name: N-(4-chloro-2-nitro-phenyl)-2-(1H-1,2,4-triazol-5-ylthio)acetamide Formula: C10H8ClN5O3S MolecularWeight: 313.72022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)[N+](=O)[O-])NC(=O)CSC2=NC=NN2

Isomeric SMILES

C1=CC(=C(C=C1Cl)[N+](=O)[O-])NC(=O)CSC2=NC=NN2

InChI

InChI=1S/C10H8ClN5O3S/c11-6-1-2-7(8(3-6)16(18)19)14-9(17)4-20-10-12-5-13-15-10/h1-3,5H,4H2,(H,14,17)(H,12,13,15)