N-(1,3-benzothiazol-2-yl)-N-[(E)-(4-nitrophenyl)methylideneamino]benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-[(E)-(4-nitrophenyl)methylideneamino]benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-[(E)-(4-nitrophenyl)methyleneamino]benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-[(E)-(4-nitrophenyl)methylideneamino]benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-[(E)-(4-nitrophenyl)methylideneamino]benzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-[(E)-(4-nitrobenzylidene)amino]benzamide Formula: C21H14N4O3S MolecularWeight: 402.42586

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)N(C2=NC3=CC=CC=C3S2)N=CC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C21H14N4O3S/c26-20(16-6-2-1-3-7-16)24(21-23-18-8-4-5-9-19(18)29-21)22-14-15-10-12-17(13-11-15)25(27)28/h1-14H/b22-14+