4-[[2-ethyl-3-(hydroxymethyl)phenyl]amino]-2-phenyl-1H-pyrrolo[2,3-b]pyridine-5-carboxamide

Systemtic Name: 4-[[2-ethyl-3-(hydroxymethyl)phenyl]amino]-2-phenyl-1H-pyrrolo[2,3-b]pyridine-5-carboxamide Openeye Name: 4-[2-ethyl-3-(hydroxymethyl)anilino]-2-phenyl-1H-pyrrolo[2,3-b]pyridine-5-carboxamide CAS Name: 4-[2-ethyl-3-(hydroxymethyl)anilino]-2-phenyl-1H-pyrrolo[2,3-b]pyridine-5-carboxamide IUPAC Name: 4-[2-ethyl-3-(hydroxymethyl)anilino]-2-phenyl-1H-pyrrolo[2,3-b]pyridine-5-carboxamide Traditional Name: 4-(2-ethyl-3-methylol-anilino)-2-phenyl-1H-pyrrolo[2,3-b]pyridine-5-carboxamide Formula: C23H22N4O2 MolecularWeight: 386.44638

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC=C1NC2=C3C=C(NC3=NC=C2C(=O)N)C4=CC=CC=C4)CO

Isomeric SMILES

CCC1=C(C=CC=C1NC2=C3C=C(NC3=NC=C2C(=O)N)C4=CC=CC=C4)CO

InChI

InChI=1S/C23H22N4O2/c1-2-16-15(13-28)9-6-10-19(16)26-21-17-11-20(14-7-4-3-5-8-14)27-23(17)25-12-18(21)22(24)29/h3-12,28H,2,13H2,1H3,(H2,24,29)(H2,25,26,27)