N-(3-ethyl-4,7-dimethyl-1,3-benzothiazol-2-ylidene)-3,5-dinitro-benzamide

Systemtic Name: N-(3-ethyl-4,7-dimethyl-1,3-benzothiazol-2-ylidene)-3,5-dinitro-benzamide Openeye Name: N-(3-ethyl-4,7-dimethyl-1,3-benzothiazol-2-ylidene)-3,5-dinitro-benzamide CAS Name: N-(3-ethyl-4,7-dimethyl-1,3-benzothiazol-2-ylidene)-3,5-dinitrobenzamide IUPAC Name: N-(3-ethyl-4,7-dimethyl-1,3-benzothiazol-2-ylidene)-3,5-dinitrobenzamide Traditional Name: N-(3-ethyl-4,7-dimethyl-1,3-benzothiazol-2-ylidene)-3,5-dinitro-benzamide Formula: C18H16N4O5S MolecularWeight: 400.40844

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2SC1=NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])C)C

Isomeric SMILES

CCN1C2=C(C=CC(=C2SC1=NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])C)C

InChI

InChI=1S/C18H16N4O5S/c1-4-20-15-10(2)5-6-11(3)16(15)28-18(20)19-17(23)12-7-13(21(24)25)9-14(8-12)22(26)27/h5-9H,4H2,1-3H3