N-[4,5-dimethyl-3-[pyridin-3-yl-(pyridin-2-ylamino)methyl]thiophen-2-yl]furan-2-carboxamide

Systemtic Name: N-[4,5-dimethyl-3-[pyridin-3-yl-(pyridin-2-ylamino)methyl]thiophen-2-yl]furan-2-carboxamide Openeye Name: N-[4,5-dimethyl-3-[3-pyridyl-(2-pyridylamino)methyl]-2-thienyl]furan-2-carboxamide CAS Name: N-[4,5-dimethyl-3-[3-pyridinyl-(2-pyridinylamino)methyl]-2-thiophenyl]-2-furancarboxamide IUPAC Name: N-[4,5-dimethyl-3-[pyridin-3-yl-(pyridin-2-ylamino)methyl]thiophen-2-yl]furan-2-carboxamide Traditional Name: N-[4,5-dimethyl-3-[3-pyridyl-(2-pyridylamino)methyl]-2-thienyl]-2-furamide Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(C2=CN=CC=C2)NC3=CC=CC=N3)NC(=O)C4=CC=CO4)C

Isomeric SMILES

CC1=C(SC(=C1C(C2=CN=CC=C2)NC3=CC=CC=N3)NC(=O)C4=CC=CO4)C

InChI

InChI=1S/C22H20N4O2S/c1-14-15(2)29-22(26-21(27)17-8-6-12-28-17)19(14)20(16-7-5-10-23-13-16)25-18-9-3-4-11-24-18/h3-13,20H,1-2H3,(H,24,25)(H,26,27)