5-[[(2R,3R,4S,5R,6R)-4,5-bis(phenylmethoxy)-6-[2-[1-(phenylsulfonyl)indol-3-yl]ethoxy]-3-(pyrazin-2-ylmethoxy)oxan-2-yl]methoxy]pentan-1-amine

Systemtic Name: 5-[[(2R,3R,4S,5R,6R)-4,5-bis(phenylmethoxy)-6-[2-[1-(phenylsulfonyl)indol-3-yl]ethoxy]-3-(pyrazin-2-ylmethoxy)oxan-2-yl]methoxy]pentan-1-amine Openeye Name: 5-[[(2R,3R,4S,5R,6R)-6-[2-[1-(benzenesulfonyl)indol-3-yl]ethoxy]-4,5-dibenzyloxy-3-(pyrazin-2-ylmethoxy)tetrahydropyran-2-yl]methoxy]pentan-1-amine CAS Name: 5-[[(2R,3R,4S,5R,6R)-6-[2-[1-(benzenesulfonyl)-3-indolyl]ethoxy]-4,5-bis(phenylmethoxy)-3-(2-pyrazinylmethoxy)-2-oxanyl]methoxy]-1-pentanamine IUPAC Name: 5-[[(2R,3R,4S,5R,6R)-6-[2-[1-(benzenesulfonyl)indol-3-yl]ethoxy]-4,5-bis(phenylmethoxy)-3-(pyrazin-2-ylmethoxy)oxan-2-yl]methoxy]pentan-1-amine Traditional Name: 5-[[(2R,3R,4S,5R,6R)-4,5-dibenzoxy-6-[2-(1-besylindol-3-yl)ethoxy]-3-(pyrazin-2-ylmethoxy)tetrahydropyran-2-yl]methoxy]pentylamine Formula: C46H52N4O8S MolecularWeight: 820.99208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2C(C(OC(C2OCC3=CC=CC=C3)OCCC4=CN(C5=CC=CC=C54)S(=O)(=O)C6=CC=CC=C6)COCCCCCN)OCC7=NC=CN=C7

Isomeric SMILES

C1=CC=C(C=C1)CO[C@H]2[C@@H]([C@H](O[C@H]([C@@H]2OCC3=CC=CC=C3)OCCC4=CN(C5=CC=CC=C54)S(=O)(=O)C6=CC=CC=C6)COCCCCCN)OCC7=NC=CN=C7

InChI

InChI=1S/C46H52N4O8S/c47-24-13-4-14-27-53-34-42-43(57-33-38-29-48-25-26-49-38)44(55-31-35-15-5-1-6-16-35)45(56-32-36-17-7-2-8-18-36)46(58-42)54-28-23-37-30-50(41-22-12-11-21-40(37)41)59(51,52)39-19-9-3-10-20-39/h1-3,5-12,15-22,25-26,29-30,42-46H,4,13-14,23-24,27-28,31-34,47H2/t42-,43-,44+,45-,46-/m1/s1