N-(3-aminocarbonyl-4,5-dihydrobenzo[g][1]benzothiol-2-yl)-5-nitro-furan-2-carboxamide

Systemtic Name: N-(3-aminocarbonyl-4,5-dihydrobenzo[g][1]benzothiol-2-yl)-5-nitro-furan-2-carboxamide Openeye Name: N-(3-carbamoyl-4,5-dihydrobenzo[g]benzothiophen-2-yl)-5-nitro-furan-2-carboxamide CAS Name: N-(3-carbamoyl-4,5-dihydrobenzo[g][1]benzothiol-2-yl)-5-nitro-2-furancarboxamide IUPAC Name: N-(3-carbamoyl-4,5-dihydrobenzo[g][1]benzothiol-2-yl)-5-nitrofuran-2-carboxamide Traditional Name: N-(3-carbamoyl-4,5-dihydrobenzo[g]benzothiophen-2-yl)-5-nitro-2-furamide Formula: C18H13N3O5S MolecularWeight: 383.37792

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=CC=CC=C31)SC(=C2C(=O)N)NC(=O)C4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

C1CC2=C(C3=CC=CC=C31)SC(=C2C(=O)N)NC(=O)C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C18H13N3O5S/c19-16(22)14-11-6-5-9-3-1-2-4-10(9)15(11)27-18(14)20-17(23)12-7-8-13(26-12)21(24)25/h1-4,7-8H,5-6H2,(H2,19,22)(H,20,23)