3-(4-nitrophenyl)-4-phenyl-5-prop-2-enylsulfanyl-1,2,4-triazole

Systemtic Name: 3-(4-nitrophenyl)-4-phenyl-5-prop-2-enylsulfanyl-1,2,4-triazole Openeye Name: 3-allylsulfanyl-5-(4-nitrophenyl)-4-phenyl-1,2,4-triazole CAS Name: 3-(4-nitrophenyl)-4-phenyl-5-(prop-2-enylthio)-1,2,4-triazole IUPAC Name: 3-(4-nitrophenyl)-4-phenyl-5-prop-2-enylsulfanyl-1,2,4-triazole Traditional Name: 3-(allylthio)-5-(4-nitrophenyl)-4-phenyl-1,2,4-triazole Formula: C17H14N4O2S MolecularWeight: 338.38366

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NN=C(N1C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C=CCSC1=NN=C(N1C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H14N4O2S/c1-2-12-24-17-19-18-16(20(17)14-6-4-3-5-7-14)13-8-10-15(11-9-13)21(22)23/h2-11H,1,12H2