2-[4-(hydroxymethyl)phenyl]-7-[(4-phenoxyphenyl)amino]thieno[3,2-b]pyridine-6-carbonitrile

Systemtic Name: 2-[4-(hydroxymethyl)phenyl]-7-[(4-phenoxyphenyl)amino]thieno[3,2-b]pyridine-6-carbonitrile Openeye Name: 2-[4-(hydroxymethyl)phenyl]-7-(4-phenoxyanilino)thieno[3,2-b]pyridine-6-carbonitrile CAS Name: 2-[4-(hydroxymethyl)phenyl]-7-(4-phenoxyanilino)-6-thieno[3,2-b]pyridinecarbonitrile IUPAC Name: 2-[4-(hydroxymethyl)phenyl]-7-(4-phenoxyanilino)thieno[3,2-b]pyridine-6-carbonitrile Traditional Name: 2-(4-methylolphenyl)-7-(4-phenoxyanilino)thieno[3,2-b]pyridine-6-carbonitrile Formula: C27H19N3O2S MolecularWeight: 449.52366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC3=C4C(=NC=C3C#N)C=C(S4)C5=CC=C(C=C5)CO

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC3=C4C(=NC=C3C#N)C=C(S4)C5=CC=C(C=C5)CO

InChI

InChI=1S/C27H19N3O2S/c28-15-20-16-29-24-14-25(19-8-6-18(17-31)7-9-19)33-27(24)26(20)30-21-10-12-23(13-11-21)32-22-4-2-1-3-5-22/h1-14,16,31H,17H2,(H,29,30)