5-(4-ethylphenyl)-3-[[(2R)-oxan-2-yl]methylsulfanyl]-1H-1,2,4-triazole

Systemtic Name: 5-(4-ethylphenyl)-3-[[(2R)-oxan-2-yl]methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-(4-ethylphenyl)-3-[[(2R)-tetrahydropyran-2-yl]methylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-(4-ethylphenyl)-3-[[(2R)-2-oxanyl]methylthio]-1H-1,2,4-triazole IUPAC Name: 5-(4-ethylphenyl)-3-[[(2R)-oxan-2-yl]methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-(4-ethylphenyl)-3-[[(2R)-tetrahydropyran-2-yl]methylthio]-1H-1,2,4-triazole Formula: C16H21N3OS MolecularWeight: 303.42244

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=NN2)SCC3CCCCO3

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=NN2)SC[C@H]3CCCCO3

InChI

InChI=1S/C16H21N3OS/c1-2-12-6-8-13(9-7-12)15-17-16(19-18-15)21-11-14-5-3-4-10-20-14/h6-9,14H,2-5,10-11H2,1H3,(H,17,18,19)/t14-/m1/s1