1-[[(3S)-3,4-dihydro-2H-1,5-benzoxathiepin-3-yl]amino]-3-(2-methoxyphenyl)sulfanyl-propan-2-ol

Systemtic Name: 1-[[(3S)-3,4-dihydro-2H-1,5-benzoxathiepin-3-yl]amino]-3-(2-methoxyphenyl)sulfanyl-propan-2-ol Openeye Name: 1-[[(3S)-3,4-dihydro-2H-1,5-benzoxathiepin-3-yl]amino]-3-(2-methoxyphenyl)sulfanyl-propan-2-ol CAS Name: 1-[[(3S)-3,4-dihydro-2H-1,5-benzoxathiepin-3-yl]amino]-3-[(2-methoxyphenyl)thio]-2-propanol IUPAC Name: 1-[[(3S)-3,4-dihydro-2H-1,5-benzoxathiepin-3-yl]amino]-3-(2-methoxyphenyl)sulfanylpropan-2-ol Traditional Name: 1-[[(3S)-3,4-dihydro-2H-1,5-benzoxathiepin-3-yl]amino]-3-[(2-methoxyphenyl)thio]propan-2-ol Formula: C19H23NO3S2 MolecularWeight: 377.52082

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1SCC(CNC2COC3=CC=CC=C3SC2)O

Isomeric SMILES

COC1=CC=CC=C1SCC(CN[C@H]2COC3=CC=CC=C3SC2)O

InChI

InChI=1S/C19H23NO3S2/c1-22-16-6-2-4-8-18(16)25-13-15(21)10-20-14-11-23-17-7-3-5-9-19(17)24-12-14/h2-9,14-15,20-21H,10-13H2,1H3/t14-,15?/m0/s1