N-[(E)-[5-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]furan-2-yl]methylideneamino]-3-nitro-benzamide

Systemtic Name: N-[(E)-[5-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]furan-2-yl]methylideneamino]-3-nitro-benzamide Openeye Name: N-[(E)-[5-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-2-furyl]methyleneamino]-3-nitro-benzamide CAS Name: N-[(E)-[5-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]-2-furanyl]methylideneamino]-3-nitrobenzamide IUPAC Name: N-[(E)-[5-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]furan-2-yl]methylideneamino]-3-nitrobenzamide Traditional Name: N-[(E)-[5-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]-2-furyl]methyleneamino]-3-nitro-benzamide Formula: C21H16N4O5S2 MolecularWeight: 468.50554

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)SC3=CC=C(O3)C=NNC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)SC3=CC=C(O3)/C=N/NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H16N4O5S2/c1-2-29-15-6-8-17-18(11-15)31-21(23-17)32-19-9-7-16(30-19)12-22-24-20(26)13-4-3-5-14(10-13)25(27)28/h3-12H,2H2,1H3,(H,24,26)/b22-12+