4-cyano-N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)benzamide

Systemtic Name: 4-cyano-N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)benzamide Openeye Name: 4-cyano-N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)benzamide CAS Name: 4-cyano-N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)benzamide IUPAC Name: 4-cyano-N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)benzamide Traditional Name: 4-cyano-N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)benzamide Formula: C17H12N4O3S MolecularWeight: 352.36718

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H12N4O3S/c1-2-20-14-8-7-13(21(23)24)9-15(14)25-17(20)19-16(22)12-5-3-11(10-18)4-6-12/h3-9H,2H2,1H3