N-[2-(1,3-benzothiazol-2-yl)phenyl]-2,4-dinitro-benzamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-2,4-dinitro-benzamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-2,4-dinitro-benzamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-2,4-dinitrobenzamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-2,4-dinitrobenzamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-2,4-dinitro-benzamide Formula: C20H12N4O5S MolecularWeight: 420.39808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3S2)NC(=O)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3S2)NC(=O)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H12N4O5S/c25-19(14-10-9-12(23(26)27)11-17(14)24(28)29)21-15-6-2-1-5-13(15)20-22-16-7-3-4-8-18(16)30-20/h1-11H,(H,21,25)