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

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-2-[(4,5-diethyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-2-[(4,5-diethyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(2-chloro-5-nitrophenyl)-2-[(4,5-diethyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-2-[(4,5-diethyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-2-[(4,5-diethyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C14H16ClN5O3S MolecularWeight: 369.82654

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1CC)SCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CCC1=NN=C(N1CC)SCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H16ClN5O3S/c1-3-12-17-18-14(19(12)4-2)24-8-13(21)16-11-7-9(20(22)23)5-6-10(11)15/h5-7H,3-4,8H2,1-2H3,(H,16,21)