N-[4-(2-phenylazanylpyridin-4-yl)pyridin-2-yl]-5-(pyridin-2-ylsulfanylmethyl)furan-2-carboxamide

Systemtic Name: N-[4-(2-phenylazanylpyridin-4-yl)pyridin-2-yl]-5-(pyridin-2-ylsulfanylmethyl)furan-2-carboxamide Openeye Name: N-[4-(2-anilino-4-pyridyl)-2-pyridyl]-5-(2-pyridylsulfanylmethyl)furan-2-carboxamide CAS Name: N-[4-(2-anilino-4-pyridinyl)-2-pyridinyl]-5-[(2-pyridinylthio)methyl]-2-furancarboxamide IUPAC Name: N-[4-(2-anilinopyridin-4-yl)pyridin-2-yl]-5-(pyridin-2-ylsulfanylmethyl)furan-2-carboxamide Traditional Name: N-[4-(2-anilino-4-pyridyl)-2-pyridyl]-5-[(2-pyridylthio)methyl]-2-furamide Formula: C27H21N5O2S MolecularWeight: 479.55294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC=CC(=C2)C3=CC(=NC=C3)NC(=O)C4=CC=C(O4)CSC5=CC=CC=N5

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC=CC(=C2)C3=CC(=NC=C3)NC(=O)C4=CC=C(O4)CSC5=CC=CC=N5

InChI

InChI=1S/C27H21N5O2S/c33-27(23-10-9-22(34-23)18-35-26-8-4-5-13-30-26)32-25-17-20(12-15-29-25)19-11-14-28-24(16-19)31-21-6-2-1-3-7-21/h1-17H,18H2,(H,28,31)(H,29,32,33)