3-[2-(3-nitrophenoxy)ethylsulfanyl]-4-(oxolan-2-ylmethyl)-5-thiophen-2-yl-1,2,4-triazole

Systemtic Name: 3-[2-(3-nitrophenoxy)ethylsulfanyl]-4-(oxolan-2-ylmethyl)-5-thiophen-2-yl-1,2,4-triazole Openeye Name: 3-[2-(3-nitrophenoxy)ethylsulfanyl]-4-(tetrahydrofuran-2-ylmethyl)-5-(2-thienyl)-1,2,4-triazole CAS Name: 3-[2-(3-nitrophenoxy)ethylthio]-4-(2-oxolanylmethyl)-5-thiophen-2-yl-1,2,4-triazole IUPAC Name: 3-[2-(3-nitrophenoxy)ethylsulfanyl]-4-(oxolan-2-ylmethyl)-5-thiophen-2-yl-1,2,4-triazole Traditional Name: 3-[2-(3-nitrophenoxy)ethylthio]-4-(tetrahydrofurfuryl)-5-(2-thienyl)-1,2,4-triazole Formula: C19H20N4O4S2 MolecularWeight: 432.5165

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=NN=C2SCCOC3=CC=CC(=C3)[N+](=O)[O-])C4=CC=CS4

Isomeric SMILES

C1CC(OC1)CN2C(=NN=C2SCCOC3=CC=CC(=C3)[N+](=O)[O-])C4=CC=CS4

InChI

InChI=1S/C19H20N4O4S2/c24-23(25)14-4-1-5-15(12-14)27-9-11-29-19-21-20-18(17-7-3-10-28-17)22(19)13-16-6-2-8-26-16/h1,3-5,7,10,12,16H,2,6,8-9,11,13H2