3-[2-[[(2R)-2-(6-azanylpyridin-3-yl)-2-oxidanyl-ethyl]amino]-2-methyl-propyl]-N-[2-(2,3-dimethyl-4-oxidanyl-phenyl)ethyl]benzamide

Systemtic Name: 3-[2-[[(2R)-2-(6-azanylpyridin-3-yl)-2-oxidanyl-ethyl]amino]-2-methyl-propyl]-N-[2-(2,3-dimethyl-4-oxidanyl-phenyl)ethyl]benzamide Openeye Name: 3-[2-[[(2R)-2-(6-amino-3-pyridyl)-2-hydroxy-ethyl]amino]-2-methyl-propyl]-N-[2-(4-hydroxy-2,3-dimethyl-phenyl)ethyl]benzamide CAS Name: 3-[2-[[(2R)-2-(6-amino-3-pyridinyl)-2-hydroxyethyl]amino]-2-methylpropyl]-N-[2-(4-hydroxy-2,3-dimethylphenyl)ethyl]benzamide IUPAC Name: 3-[2-[[(2R)-2-(6-aminopyridin-3-yl)-2-hydroxyethyl]amino]-2-methylpropyl]-N-[2-(4-hydroxy-2,3-dimethylphenyl)ethyl]benzamide Traditional Name: 3-[2-[[(2R)-2-(6-amino-3-pyridyl)-2-hydroxy-ethyl]amino]-2-methyl-propyl]-N-[2-(4-hydroxy-2,3-dimethyl-phenyl)ethyl]benzamide Formula: C28H36N4O3 MolecularWeight: 476.61044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C)O)CCNC(=O)C2=CC(=CC=C2)CC(C)(C)NCC(C3=CN=C(C=C3)N)O

Isomeric SMILES

CC1=C(C=CC(=C1C)O)CCNC(=O)C2=CC(=CC=C2)CC(C)(C)NC[C@@H](C3=CN=C(C=C3)N)O

InChI

InChI=1S/C28H36N4O3/c1-18-19(2)24(33)10-8-21(18)12-13-30-27(35)22-7-5-6-20(14-22)15-28(3,4)32-17-25(34)23-9-11-26(29)31-16-23/h5-11,14,16,25,32-34H,12-13,15,17H2,1-4H3,(H2,29,31)(H,30,35)/t25-/m0/s1