6-[4-[3-[[(2S)-3-(1H-indol-4-yloxy)-2-oxidanyl-propyl]amino]-3-methyl-butyl]phenoxy]pyridine-3-carboxamide

Systemtic Name: 6-[4-[3-[[(2S)-3-(1H-indol-4-yloxy)-2-oxidanyl-propyl]amino]-3-methyl-butyl]phenoxy]pyridine-3-carboxamide Openeye Name: 6-[4-[3-[[(2S)-2-hydroxy-3-(1H-indol-4-yloxy)propyl]amino]-3-methyl-butyl]phenoxy]pyridine-3-carboxamide CAS Name: 6-[4-[3-[[(2S)-2-hydroxy-3-(1H-indol-4-yloxy)propyl]amino]-3-methylbutyl]phenoxy]-3-pyridinecarboxamide IUPAC Name: 6-[4-[3-[[(2S)-2-hydroxy-3-(1H-indol-4-yloxy)propyl]amino]-3-methylbutyl]phenoxy]pyridine-3-carboxamide Traditional Name: 6-[4-[3-[[(2S)-2-hydroxy-3-(1H-indol-4-yloxy)propyl]amino]-3-methyl-butyl]phenoxy]nicotinamide Formula: C28H32N4O4 MolecularWeight: 488.57808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCC1=CC=C(C=C1)OC2=NC=C(C=C2)C(=O)N)NCC(COC3=CC=CC4=C3C=CN4)O

Isomeric SMILES

CC(C)(CCC1=CC=C(C=C1)OC2=NC=C(C=C2)C(=O)N)NC[C@@H](COC3=CC=CC4=C3C=CN4)O

InChI

InChI=1S/C28H32N4O4/c1-28(2,32-17-21(33)18-35-25-5-3-4-24-23(25)13-15-30-24)14-12-19-6-9-22(10-7-19)36-26-11-8-20(16-31-26)27(29)34/h3-11,13,15-16,21,30,32-33H,12,14,17-18H2,1-2H3,(H2,29,34)/t21-/m0/s1