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

Systemtic Name: 2-(1,2-benzothiazol-3-yl)-N-[(E)-(3-nitrophenyl)methylideneamino]ethanamide Openeye Name: 2-(1,2-benzothiazol-3-yl)-N-[(E)-(3-nitrophenyl)methyleneamino]acetamide CAS Name: 2-(1,2-benzothiazol-3-yl)-N-[(E)-(3-nitrophenyl)methylideneamino]acetamide IUPAC Name: 2-(1,2-benzothiazol-3-yl)-N-[(E)-(3-nitrophenyl)methylideneamino]acetamide Traditional Name: 2-(1,2-benzothiazol-3-yl)-N-[(E)-(3-nitrobenzylidene)amino]acetamide Formula: C16H12N4O3S MolecularWeight: 340.35648

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NS2)CC(=O)NN=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NS2)CC(=O)N/N=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H12N4O3S/c21-16(9-14-13-6-1-2-7-15(13)24-19-14)18-17-10-11-4-3-5-12(8-11)20(22)23/h1-8,10H,9H2,(H,18,21)/b17-10+