N-[3-aminocarbonyl-4-(3,4-dimethylphenyl)thiophen-2-yl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[3-aminocarbonyl-4-(3,4-dimethylphenyl)thiophen-2-yl]-5-nitro-furan-2-carboxamide Openeye Name: N-[3-carbamoyl-4-(3,4-dimethylphenyl)-2-thienyl]-5-nitro-furan-2-carboxamide CAS Name: N-[3-carbamoyl-4-(3,4-dimethylphenyl)-2-thiophenyl]-5-nitro-2-furancarboxamide IUPAC Name: N-[3-carbamoyl-4-(3,4-dimethylphenyl)thiophen-2-yl]-5-nitrofuran-2-carboxamide Traditional Name: N-[3-carbamoyl-4-(3,4-dimethylphenyl)-2-thienyl]-5-nitro-2-furamide Formula: C18H15N3O5S MolecularWeight: 385.3938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC(=C2C(=O)N)NC(=O)C3=CC=C(O3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC(=C2C(=O)N)NC(=O)C3=CC=C(O3)[N+](=O)[O-])C

InChI

InChI=1S/C18H15N3O5S/c1-9-3-4-11(7-10(9)2)12-8-27-18(15(12)16(19)22)20-17(23)13-5-6-14(26-13)21(24)25/h3-8H,1-2H3,(H2,19,22)(H,20,23)