N-(1,3-benzothiazol-2-yl)-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]-2-phenyl-ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]-2-phenyl-ethanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-[(E)-(5-nitro-2-furyl)methyleneamino]-2-phenyl-acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-[(E)-(5-nitro-2-furanyl)methylideneamino]-2-phenylacetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]-2-phenylacetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-[(E)-(5-nitro-2-furyl)methyleneamino]-2-phenyl-acetamide Formula: C20H14N4O4S MolecularWeight: 406.41456

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)N(C2=NC3=CC=CC=C3S2)N=CC4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)N(C2=NC3=CC=CC=C3S2)/N=C/C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C20H14N4O4S/c25-18(12-14-6-2-1-3-7-14)23(20-22-16-8-4-5-9-17(16)29-20)21-13-15-10-11-19(28-15)24(26)27/h1-11,13H,12H2/b21-13+