N-(3-methoxyphenyl)-5-(oxan-2-ylmethylsulfanyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: N-(3-methoxyphenyl)-5-(oxan-2-ylmethylsulfanyl)-1,3,4-thiadiazol-2-amine Openeye Name: N-(3-methoxyphenyl)-5-(tetrahydropyran-2-ylmethylsulfanyl)-1,3,4-thiadiazol-2-amine CAS Name: N-(3-methoxyphenyl)-5-(2-oxanylmethylthio)-1,3,4-thiadiazol-2-amine IUPAC Name: N-(3-methoxyphenyl)-5-(oxan-2-ylmethylsulfanyl)-1,3,4-thiadiazol-2-amine Traditional Name: (3-methoxyphenyl)-[5-(tetrahydropyran-2-ylmethylthio)-1,3,4-thiadiazol-2-yl]amine Formula: C15H19N3O2S2 MolecularWeight: 337.46026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=NN=C(S2)SCC3CCCCO3

Isomeric SMILES

COC1=CC=CC(=C1)NC2=NN=C(S2)SCC3CCCCO3

InChI

InChI=1S/C15H19N3O2S2/c1-19-12-7-4-5-11(9-12)16-14-17-18-15(22-14)21-10-13-6-2-3-8-20-13/h4-5,7,9,13H,2-3,6,8,10H2,1H3,(H,16,17)