3-[[2,2-bis(ethylsulfanyl)-3,4-dihydrochromen-4-yl]amino]propan-1-ol

Systemtic Name: 3-[[2,2-bis(ethylsulfanyl)-3,4-dihydrochromen-4-yl]amino]propan-1-ol Openeye Name: 3-[[2,2-bis(ethylsulfanyl)chroman-4-yl]amino]propan-1-ol CAS Name: 3-[[2,2-bis(ethylthio)-3,4-dihydro-2H-1-benzopyran-4-yl]amino]-1-propanol IUPAC Name: 3-[[2,2-bis(ethylsulfanyl)-3,4-dihydrochromen-4-yl]amino]propan-1-ol Traditional Name: 3-[[2,2-bis(ethylthio)chroman-4-yl]amino]propan-1-ol Formula: C16H25NO2S2 MolecularWeight: 327.5052

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1(CC(C2=CC=CC=C2O1)NCCCO)SCC

Isomeric SMILES

CCSC1(CC(C2=CC=CC=C2O1)NCCCO)SCC

InChI

InChI=1S/C16H25NO2S2/c1-3-20-16(21-4-2)12-14(17-10-7-11-18)13-8-5-6-9-15(13)19-16/h5-6,8-9,14,17-18H,3-4,7,10-12H2,1-2H3