N-[5-methyl-4-phenyl-3-(pyridin-3-ylmethylcarbamoyl)thiophen-2-yl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[5-methyl-4-phenyl-3-(pyridin-3-ylmethylcarbamoyl)thiophen-2-yl]-5-nitro-furan-2-carboxamide Openeye Name: N-[5-methyl-4-phenyl-3-(3-pyridylmethylcarbamoyl)-2-thienyl]-5-nitro-furan-2-carboxamide CAS Name: N-[5-methyl-3-[oxo-(3-pyridinylmethylamino)methyl]-4-phenyl-2-thiophenyl]-5-nitro-2-furancarboxamide IUPAC Name: N-[5-methyl-4-phenyl-3-(pyridin-3-ylmethylcarbamoyl)thiophen-2-yl]-5-nitrofuran-2-carboxamide Traditional Name: N-[5-methyl-4-phenyl-3-(3-pyridylmethylcarbamoyl)-2-thienyl]-5-nitro-2-furamide Formula: C23H18N4O5S MolecularWeight: 462.47782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)C2=CC=C(O2)[N+](=O)[O-])C(=O)NCC3=CN=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)C2=CC=C(O2)[N+](=O)[O-])C(=O)NCC3=CN=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H18N4O5S/c1-14-19(16-7-3-2-4-8-16)20(22(29)25-13-15-6-5-11-24-12-15)23(33-14)26-21(28)17-9-10-18(32-17)27(30)31/h2-12H,13H2,1H3,(H,25,29)(H,26,28)