2-chloranyl-N-(6-methyl-1,3-benzothiazol-2-yl)-3,5-dinitro-benzamide

Systemtic Name: 2-chloranyl-N-(6-methyl-1,3-benzothiazol-2-yl)-3,5-dinitro-benzamide Openeye Name: 2-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)-3,5-dinitro-benzamide CAS Name: 2-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)-3,5-dinitrobenzamide IUPAC Name: 2-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)-3,5-dinitrobenzamide Traditional Name: 2-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)-3,5-dinitro-benzamide Formula: C15H9ClN4O5S MolecularWeight: 392.77376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CC(=C3Cl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CC(=C3Cl)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H9ClN4O5S/c1-7-2-3-10-12(4-7)26-15(17-10)18-14(21)9-5-8(19(22)23)6-11(13(9)16)20(24)25/h2-6H,1H3,(H,17,18,21)