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

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(2-chloro-5-nitrophenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]acetamide Formula: C11H10ClN5O3S MolecularWeight: 327.7468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1)SCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=NC(=NN1)SCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C11H10ClN5O3S/c1-6-13-11(16-15-6)21-5-10(18)14-9-4-7(17(19)20)2-3-8(9)12/h2-4H,5H2,1H3,(H,14,18)(H,13,15,16)