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

Systemtic Name: N-[4,5-dimethyl-3-[(3-nitrophenyl)-(pyridin-2-ylamino)methyl]thiophen-2-yl]furan-2-carboxamide Openeye Name: N-[4,5-dimethyl-3-[(3-nitrophenyl)-(2-pyridylamino)methyl]-2-thienyl]furan-2-carboxamide CAS Name: N-[4,5-dimethyl-3-[(3-nitrophenyl)-(2-pyridinylamino)methyl]-2-thiophenyl]-2-furancarboxamide IUPAC Name: N-[4,5-dimethyl-3-[(3-nitrophenyl)-(pyridin-2-ylamino)methyl]thiophen-2-yl]furan-2-carboxamide Traditional Name: N-[4,5-dimethyl-3-[(3-nitrophenyl)-(2-pyridylamino)methyl]-2-thienyl]-2-furamide Formula: C23H20N4O4S MolecularWeight: 448.4943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(C2=CC(=CC=C2)[N+](=O)[O-])NC3=CC=CC=N3)NC(=O)C4=CC=CO4)C

Isomeric SMILES

CC1=C(SC(=C1C(C2=CC(=CC=C2)[N+](=O)[O-])NC3=CC=CC=N3)NC(=O)C4=CC=CO4)C

InChI

InChI=1S/C23H20N4O4S/c1-14-15(2)32-23(26-22(28)18-9-6-12-31-18)20(14)21(25-19-10-3-4-11-24-19)16-7-5-8-17(13-16)27(29)30/h3-13,21H,1-2H3,(H,24,25)(H,26,28)