5-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-phenyl-1,2,4-oxadiazole

Systemtic Name: 5-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-phenyl-1,2,4-oxadiazole Openeye Name: 5-[(4-allyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-phenyl-1,2,4-oxadiazole CAS Name: 5-[[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]methyl]-3-phenyl-1,2,4-oxadiazole IUPAC Name: 5-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-phenyl-1,2,4-oxadiazole Traditional Name: 5-[[(4-allyl-5-cyclohexyl-1,2,4-triazol-3-yl)thio]methyl]-3-phenyl-1,2,4-oxadiazole Formula: C20H23N5OS MolecularWeight: 381.49452

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC2=NC(=NO2)C3=CC=CC=C3)C4CCCCC4

Isomeric SMILES

C=CCN1C(=NN=C1SCC2=NC(=NO2)C3=CC=CC=C3)C4CCCCC4

InChI

InChI=1S/C20H23N5OS/c1-2-13-25-19(16-11-7-4-8-12-16)22-23-20(25)27-14-17-21-18(24-26-17)15-9-5-3-6-10-15/h2-3,5-6,9-10,16H,1,4,7-8,11-14H2