2-[4-[2-methyl-2-[[2-oxidanyl-3-(2-thiophen-2-ylphenoxy)propyl]amino]propyl]phenoxy]pyridine-3-carboxamide

Systemtic Name: 2-[4-[2-methyl-2-[[2-oxidanyl-3-(2-thiophen-2-ylphenoxy)propyl]amino]propyl]phenoxy]pyridine-3-carboxamide Openeye Name: 2-[4-[2-[[2-hydroxy-3-[2-(2-thienyl)phenoxy]propyl]amino]-2-methyl-propyl]phenoxy]pyridine-3-carboxamide CAS Name: 2-[4-[2-[[2-hydroxy-3-(2-thiophen-2-ylphenoxy)propyl]amino]-2-methylpropyl]phenoxy]-3-pyridinecarboxamide IUPAC Name: 2-[4-[2-[[2-hydroxy-3-(2-thiophen-2-ylphenoxy)propyl]amino]-2-methylpropyl]phenoxy]pyridine-3-carboxamide Traditional Name: 2-[4-[2-[[2-hydroxy-3-[2-(2-thienyl)phenoxy]propyl]amino]-2-methyl-propyl]phenoxy]nicotinamide Formula: C29H31N3O4S MolecularWeight: 517.63914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=CC=C(C=C1)OC2=C(C=CC=N2)C(=O)N)NCC(COC3=CC=CC=C3C4=CC=CS4)O

Isomeric SMILES

CC(C)(CC1=CC=C(C=C1)OC2=C(C=CC=N2)C(=O)N)NCC(COC3=CC=CC=C3C4=CC=CS4)O

InChI

InChI=1S/C29H31N3O4S/c1-29(2,17-20-11-13-22(14-12-20)36-28-24(27(30)34)8-5-15-31-28)32-18-21(33)19-35-25-9-4-3-7-23(25)26-10-6-16-37-26/h3-16,21,32-33H,17-19H2,1-2H3,(H2,30,34)