5-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methylsulfanyl]-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methylsulfanyl]-1,3,4-thiadiazol-2-amine Openeye Name: 5-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methylsulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: 5-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methylthio]-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methylsulfanyl]-1,3,4-thiadiazol-2-amine Traditional Name: [5-[[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]methylthio]-1,3,4-thiadiazol-2-yl]amine Formula: C14H17N3O2S2 MolecularWeight: 323.43368

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)CSC3=NN=C(S3)N

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C[C@@H](O2)C)CSC3=NN=C(S3)N

InChI

InChI=1S/C14H17N3O2S2/c1-3-18-11-5-9-4-8(2)19-12(9)6-10(11)7-20-14-17-16-13(15)21-14/h5-6,8H,3-4,7H2,1-2H3,(H2,15,16)/t8-/m0/s1