3-[(4-nitrophenyl)methylsulfanyl]-4-phenyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole

Systemtic Name: 3-[(4-nitrophenyl)methylsulfanyl]-4-phenyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole Openeye Name: 3-[(4-nitrophenyl)methylsulfanyl]-4-phenyl-5-(2-thienylmethyl)-1,2,4-triazole CAS Name: 3-[(4-nitrophenyl)methylthio]-4-phenyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole IUPAC Name: 3-[(4-nitrophenyl)methylsulfanyl]-4-phenyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole Traditional Name: 3-[(4-nitrobenzyl)thio]-4-phenyl-5-(2-thenyl)-1,2,4-triazole Formula: C20H16N4O2S2 MolecularWeight: 408.49664

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)[N+](=O)[O-])CC4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)[N+](=O)[O-])CC4=CC=CS4

InChI

InChI=1S/C20H16N4O2S2/c25-24(26)17-10-8-15(9-11-17)14-28-20-22-21-19(13-18-7-4-12-27-18)23(20)16-5-2-1-3-6-16/h1-12H,13-14H2