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

Systemtic Name: 5-(2-nitrophenyl)-N-[2-(propanoylamino)-1,3-benzothiazol-6-yl]furan-2-carboxamide Openeye Name: 5-(2-nitrophenyl)-N-[2-(propanoylamino)-1,3-benzothiazol-6-yl]furan-2-carboxamide CAS Name: 5-(2-nitrophenyl)-N-[2-(1-oxopropylamino)-1,3-benzothiazol-6-yl]-2-furancarboxamide IUPAC Name: 5-(2-nitrophenyl)-N-[2-(propanoylamino)-1,3-benzothiazol-6-yl]furan-2-carboxamide Traditional Name: 5-(2-nitrophenyl)-N-(2-propionamido-1,3-benzothiazol-6-yl)-2-furamide Formula: C21H16N4O5S MolecularWeight: 436.44054

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=C(O3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=C(O3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H16N4O5S/c1-2-19(26)24-21-23-14-8-7-12(11-18(14)31-21)22-20(27)17-10-9-16(30-17)13-5-3-4-6-15(13)25(28)29/h3-11H,2H2,1H3,(H,22,27)(H,23,24,26)