N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-5-nitro-furan-2-carboxamide Openeye Name: N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-5-nitro-furan-2-carboxamide CAS Name: 5-nitro-N-[2-(1-oxobutylamino)-1,3-benzothiazol-6-yl]-2-furancarboxamide IUPAC Name: N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-5-nitrofuran-2-carboxamide Traditional Name: N-(2-butyramido-1,3-benzothiazol-6-yl)-5-nitro-2-furamide Formula: C16H14N4O5S MolecularWeight: 374.37116

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O5S/c1-2-3-13(21)19-16-18-10-5-4-9(8-12(10)26-16)17-15(22)11-6-7-14(25-11)20(23)24/h4-8H,2-3H2,1H3,(H,17,22)(H,18,19,21)