3,4-dicyclopropyl-5-[(4-nitrophenyl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 3,4-dicyclopropyl-5-[(4-nitrophenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3,4-dicyclopropyl-5-[(4-nitrophenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 3,4-dicyclopropyl-5-[(4-nitrophenyl)methylthio]-1,2,4-triazole IUPAC Name: 3,4-dicyclopropyl-5-[(4-nitrophenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3,4-dicyclopropyl-5-[(4-nitrobenzyl)thio]-1,2,4-triazole Formula: C15H16N4O2S MolecularWeight: 316.37814

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2C3CC3)SCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC1C2=NN=C(N2C3CC3)SCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C15H16N4O2S/c20-19(21)13-5-1-10(2-6-13)9-22-15-17-16-14(11-3-4-11)18(15)12-7-8-12/h1-2,5-6,11-12H,3-4,7-9H2