3,5-dinitro-N-(3,4,6-trimethyl-1,3-benzothiazol-2-ylidene)benzamide

Systemtic Name: 3,5-dinitro-N-(3,4,6-trimethyl-1,3-benzothiazol-2-ylidene)benzamide Openeye Name: 3,5-dinitro-N-(3,4,6-trimethyl-1,3-benzothiazol-2-ylidene)benzamide CAS Name: 3,5-dinitro-N-(3,4,6-trimethyl-1,3-benzothiazol-2-ylidene)benzamide IUPAC Name: 3,5-dinitro-N-(3,4,6-trimethyl-1,3-benzothiazol-2-ylidene)benzamide Traditional Name: 3,5-dinitro-N-(3,4,6-trimethyl-1,3-benzothiazol-2-ylidene)benzamide Formula: C17H14N4O5S MolecularWeight: 386.38186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])N2C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])N2C)C

InChI

InChI=1S/C17H14N4O5S/c1-9-4-10(2)15-14(5-9)27-17(19(15)3)18-16(22)11-6-12(20(23)24)8-13(7-11)21(25)26/h4-8H,1-3H3