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

Systemtic Name: 4-cyclopropyl-3-[(3-nitrophenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 4-cyclopropyl-3-[(3-nitrophenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 4-cyclopropyl-3-[(3-nitrophenyl)methylthio]-1,2,4-triazole IUPAC Name: 4-cyclopropyl-3-[(3-nitrophenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 4-cyclopropyl-3-[(3-nitrobenzyl)thio]-1,2,4-triazole Formula: C12H12N4O2S MolecularWeight: 276.31428

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=NN=C2SCC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC1N2C=NN=C2SCC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C12H12N4O2S/c17-16(18)11-3-1-2-9(6-11)7-19-12-14-13-8-15(12)10-4-5-10/h1-3,6,8,10H,4-5,7H2