4-cyclohexyl-3-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole

Systemtic Name: 4-cyclohexyl-3-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole Openeye Name: 4-cyclohexyl-3-[(E)-2-(5-nitro-2-furyl)vinyl]sulfanyl-5-(2-thienylmethyl)-1,2,4-triazole CAS Name: 4-cyclohexyl-3-[[(E)-2-(5-nitro-2-furanyl)ethenyl]thio]-5-(thiophen-2-ylmethyl)-1,2,4-triazole IUPAC Name: 4-cyclohexyl-3-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole Traditional Name: 4-cyclohexyl-3-[[(E)-2-(5-nitro-2-furyl)vinyl]thio]-5-(2-thenyl)-1,2,4-triazole Formula: C19H20N4O3S2 MolecularWeight: 416.5171

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=C2SC=CC3=CC=C(O3)[N+](=O)[O-])CC4=CC=CS4

Isomeric SMILES

C1CCC(CC1)N2C(=NN=C2S/C=C/C3=CC=C(O3)[N+](=O)[O-])CC4=CC=CS4

InChI

InChI=1S/C19H20N4O3S2/c24-23(25)18-9-8-15(26-18)10-12-28-19-21-20-17(13-16-7-4-11-27-16)22(19)14-5-2-1-3-6-14/h4,7-12,14H,1-3,5-6,13H2/b12-10+