N-[3-aminocarbonyl-5-methyl-4-(4-propan-2-ylphenyl)thiophen-2-yl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[3-aminocarbonyl-5-methyl-4-(4-propan-2-ylphenyl)thiophen-2-yl]-5-nitro-furan-2-carboxamide Openeye Name: N-[3-carbamoyl-4-(4-isopropylphenyl)-5-methyl-2-thienyl]-5-nitro-furan-2-carboxamide CAS Name: N-[3-carbamoyl-5-methyl-4-(4-propan-2-ylphenyl)-2-thiophenyl]-5-nitro-2-furancarboxamide IUPAC Name: N-[3-carbamoyl-5-methyl-4-(4-propan-2-ylphenyl)thiophen-2-yl]-5-nitrofuran-2-carboxamide Traditional Name: N-(3-carbamoyl-5-methyl-4-p-cumenyl-2-thienyl)-5-nitro-2-furamide Formula: C20H19N3O5S MolecularWeight: 413.44696

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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)N)C3=CC=C(C=C3)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C20H19N3O5S/c1-10(2)12-4-6-13(7-5-12)16-11(3)29-20(17(16)18(21)24)22-19(25)14-8-9-15(28-14)23(26)27/h4-10H,1-3H3,(H2,21,24)(H,22,25)