2-[(2R)-3-[[(3R)-3,4-dihydro-2H-1,5-benzoxathiepin-3-yl]amino]-2-oxidanyl-propyl]sulfanylphenol

Systemtic Name: 2-[(2R)-3-[[(3R)-3,4-dihydro-2H-1,5-benzoxathiepin-3-yl]amino]-2-oxidanyl-propyl]sulfanylphenol Openeye Name: 2-[(2R)-3-[[(3R)-3,4-dihydro-2H-1,5-benzoxathiepin-3-yl]amino]-2-hydroxy-propyl]sulfanylphenol CAS Name: 2-[[(2R)-3-[[(3R)-3,4-dihydro-2H-1,5-benzoxathiepin-3-yl]amino]-2-hydroxypropyl]thio]phenol IUPAC Name: 2-[(2R)-3-[[(3R)-3,4-dihydro-2H-1,5-benzoxathiepin-3-yl]amino]-2-hydroxypropyl]sulfanylphenol Traditional Name: 2-[[(2R)-3-[[(3R)-3,4-dihydro-2H-1,5-benzoxathiepin-3-yl]amino]-2-hydroxy-propyl]thio]phenol Formula: C18H21NO3S2 MolecularWeight: 363.49424

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CSC2=CC=CC=C2O1)NCC(CSC3=CC=CC=C3O)O

Isomeric SMILES

C1[C@H](CSC2=CC=CC=C2O1)NC[C@H](CSC3=CC=CC=C3O)O

InChI

InChI=1S/C18H21NO3S2/c20-14(12-24-17-7-3-1-5-15(17)21)9-19-13-10-22-16-6-2-4-8-18(16)23-11-13/h1-8,13-14,19-21H,9-12H2/t13-,14-/m1/s1