2-[(5-ethyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-nitrophenyl)ethanamide

Systemtic Name: 2-[(5-ethyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-nitrophenyl)ethanamide Openeye Name: 2-[(5-ethyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-nitrophenyl)acetamide CAS Name: 2-[(5-ethyl-4-methyl-1,2,4-triazol-3-yl)thio]-N-(2-nitrophenyl)acetamide IUPAC Name: 2-[(5-ethyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-nitrophenyl)acetamide Traditional Name: 2-[(5-ethyl-4-methyl-1,2,4-triazol-3-yl)thio]-N-(2-nitrophenyl)acetamide Formula: C13H15N5O3S MolecularWeight: 321.3549

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1C)SCC(=O)NC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCC1=NN=C(N1C)SCC(=O)NC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C13H15N5O3S/c1-3-11-15-16-13(17(11)2)22-8-12(19)14-9-6-4-5-7-10(9)18(20)21/h4-7H,3,8H2,1-2H3,(H,14,19)