N-(3-ethylsulfanyl-5-methyl-1,2,4-triazol-4-yl)-2-(2-nitrophenoxy)ethanamide

Systemtic Name: N-(3-ethylsulfanyl-5-methyl-1,2,4-triazol-4-yl)-2-(2-nitrophenoxy)ethanamide Openeye Name: N-(3-ethylsulfanyl-5-methyl-1,2,4-triazol-4-yl)-2-(2-nitrophenoxy)acetamide CAS Name: N-[3-(ethylthio)-5-methyl-1,2,4-triazol-4-yl]-2-(2-nitrophenoxy)acetamide IUPAC Name: N-(3-ethylsulfanyl-5-methyl-1,2,4-triazol-4-yl)-2-(2-nitrophenoxy)acetamide Traditional Name: N-[3-(ethylthio)-5-methyl-1,2,4-triazol-4-yl]-2-(2-nitrophenoxy)acetamide Formula: C13H15N5O4S MolecularWeight: 337.3543

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1NC(=O)COC2=CC=CC=C2[N+](=O)[O-])C

Isomeric SMILES

CCSC1=NN=C(N1NC(=O)COC2=CC=CC=C2[N+](=O)[O-])C

InChI

InChI=1S/C13H15N5O4S/c1-3-23-13-15-14-9(2)17(13)16-12(19)8-22-11-7-5-4-6-10(11)18(20)21/h4-7H,3,8H2,1-2H3,(H,16,19)