3-(oxan-2-ylmethylsulfanyl)-5-[(4-propan-2-ylphenoxy)methyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-(oxan-2-ylmethylsulfanyl)-5-[(4-propan-2-ylphenoxy)methyl]-1,2,4-triazol-4-amine Openeye Name: 3-[(4-isopropylphenoxy)methyl]-5-(tetrahydropyran-2-ylmethylsulfanyl)-1,2,4-triazol-4-amine CAS Name: 3-(2-oxanylmethylthio)-5-[(4-propan-2-ylphenoxy)methyl]-1,2,4-triazol-4-amine IUPAC Name: 3-(oxan-2-ylmethylsulfanyl)-5-[(4-propan-2-ylphenoxy)methyl]-1,2,4-triazol-4-amine Traditional Name: [3-[(4-isopropylphenoxy)methyl]-5-(tetrahydropyran-2-ylmethylthio)-1,2,4-triazol-4-yl]amine Formula: C18H26N4O2S MolecularWeight: 362.48964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OCC2=NN=C(N2N)SCC3CCCCO3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OCC2=NN=C(N2N)SCC3CCCCO3

InChI

InChI=1S/C18H26N4O2S/c1-13(2)14-6-8-15(9-7-14)24-11-17-20-21-18(22(17)19)25-12-16-5-3-4-10-23-16/h6-9,13,16H,3-5,10-12,19H2,1-2H3