N-[(2R,3R,4S,5R)-2-[6-[2-(3,4-dimethoxyphenyl)ethylamino]purin-9-yl]-5-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl]-1H-indole-5-carboxamide

Systemtic Name: N-[(2R,3R,4S,5R)-2-[6-[2-(3,4-dimethoxyphenyl)ethylamino]purin-9-yl]-5-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl]-1H-indole-5-carboxamide Openeye Name: N-[(2R,3R,4S,5R)-2-[6-[2-(3,4-dimethoxyphenyl)ethylamino]purin-9-yl]-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-3-yl]-1H-indole-5-carboxamide CAS Name: N-[(2R,3R,4S,5R)-2-[6-[2-(3,4-dimethoxyphenyl)ethylamino]-9-purinyl]-4-hydroxy-5-(hydroxymethyl)-3-oxolanyl]-1H-indole-5-carboxamide IUPAC Name: N-[(2R,3R,4S,5R)-2-[6-[2-(3,4-dimethoxyphenyl)ethylamino]purin-9-yl]-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl]-1H-indole-5-carboxamide Traditional Name: N-[(2R,3R,4S,5R)-2-[6-(homoveratrylamino)purin-9-yl]-4-hydroxy-5-methylol-tetrahydrofuran-3-yl]-1H-indole-5-carboxamide Formula: C29H31N7O6 MolecularWeight: 573.59974

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC2=NC=NC3=C2N=CN3C4C(C(C(O4)CO)O)NC(=O)C5=CC6=C(C=C5)NC=C6)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC2=NC=NC3=C2N=CN3[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)NC(=O)C5=CC6=C(C=C5)NC=C6)OC

InChI

InChI=1S/C29H31N7O6/c1-40-20-6-3-16(11-21(20)41-2)7-9-31-26-24-27(33-14-32-26)36(15-34-24)29-23(25(38)22(13-37)42-29)35-28(39)18-4-5-19-17(12-18)8-10-30-19/h3-6,8,10-12,14-15,22-23,25,29-30,37-38H,7,9,13H2,1-2H3,(H,35,39)(H,31,32,33)/t22-,23-,25-,29-/m1/s1