N-(2-ethoxyphenyl)-5-[[(2S)-oxan-2-yl]methylsulfanyl]-1,3,4-thiadiazol-2-amine

Systemtic Name: N-(2-ethoxyphenyl)-5-[[(2S)-oxan-2-yl]methylsulfanyl]-1,3,4-thiadiazol-2-amine Openeye Name: N-(2-ethoxyphenyl)-5-[[(2S)-tetrahydropyran-2-yl]methylsulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: N-(2-ethoxyphenyl)-5-[[(2S)-2-oxanyl]methylthio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-(2-ethoxyphenyl)-5-[[(2S)-oxan-2-yl]methylsulfanyl]-1,3,4-thiadiazol-2-amine Traditional Name: o-phenetyl-[5-[[(2S)-tetrahydropyran-2-yl]methylthio]-1,3,4-thiadiazol-2-yl]amine Formula: C16H21N3O2S2 MolecularWeight: 351.48684

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC2=NN=C(S2)SCC3CCCCO3

Isomeric SMILES

CCOC1=CC=CC=C1NC2=NN=C(S2)SC[C@@H]3CCCCO3

InChI

InChI=1S/C16H21N3O2S2/c1-2-20-14-9-4-3-8-13(14)17-15-18-19-16(23-15)22-11-12-7-5-6-10-21-12/h3-4,8-9,12H,2,5-7,10-11H2,1H3,(H,17,18)/t12-/m0/s1