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

Systemtic Name: N-(3-methylphenyl)-5-[[(2S)-oxan-2-yl]methylsulfanyl]-1,3,4-thiadiazol-2-amine Openeye Name: N-(m-tolyl)-5-[[(2S)-tetrahydropyran-2-yl]methylsulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: N-(3-methylphenyl)-5-[[(2S)-2-oxanyl]methylthio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-(3-methylphenyl)-5-[[(2S)-oxan-2-yl]methylsulfanyl]-1,3,4-thiadiazol-2-amine Traditional Name: m-tolyl-[5-[[(2S)-tetrahydropyran-2-yl]methylthio]-1,3,4-thiadiazol-2-yl]amine Formula: C15H19N3OS2 MolecularWeight: 321.46086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NN=C(S2)SCC3CCCCO3

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NN=C(S2)SC[C@@H]3CCCCO3

InChI

InChI=1S/C15H19N3OS2/c1-11-5-4-6-12(9-11)16-14-17-18-15(21-14)20-10-13-7-2-3-8-19-13/h4-6,9,13H,2-3,7-8,10H2,1H3,(H,16,17)/t13-/m0/s1