3-(4-methoxyphenyl)-5-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanyl-4-propan-2-yl-1,2,4-triazole

Systemtic Name: 3-(4-methoxyphenyl)-5-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanyl-4-propan-2-yl-1,2,4-triazole Openeye Name: 4-isopropyl-3-(4-methoxyphenyl)-5-[(E)-2-(5-nitro-2-furyl)vinyl]sulfanyl-1,2,4-triazole CAS Name: 3-(4-methoxyphenyl)-5-[[(E)-2-(5-nitro-2-furanyl)ethenyl]thio]-4-propan-2-yl-1,2,4-triazole IUPAC Name: 3-(4-methoxyphenyl)-5-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanyl-4-propan-2-yl-1,2,4-triazole Traditional Name: 4-isopropyl-3-(4-methoxyphenyl)-5-[[(E)-2-(5-nitro-2-furyl)vinyl]thio]-1,2,4-triazole Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=NN=C1SC=CC2=CC=C(O2)[N+](=O)[O-])C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)N1C(=NN=C1S/C=C/C2=CC=C(O2)[N+](=O)[O-])C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H18N4O4S/c1-12(2)21-17(13-4-6-14(25-3)7-5-13)19-20-18(21)27-11-10-15-8-9-16(26-15)22(23)24/h4-12H,1-3H3/b11-10+