3-cyclopropyl-5-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-cyclopropyl-5-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-cyclopropyl-5-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-cyclopropyl-5-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-cyclopropyl-5-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-cyclopropyl-5-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylthio]-1,2,4-triazol-4-yl]amine Formula: C14H13N7O3S MolecularWeight: 359.36312

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2N)SCC3=NN=C(O3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC1C2=NN=C(N2N)SCC3=NN=C(O3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C14H13N7O3S/c15-20-12(8-1-2-8)17-19-14(20)25-7-11-16-18-13(24-11)9-3-5-10(6-4-9)21(22)23/h3-6,8H,1-2,7,15H2