N-[3-(1,3-benzothiazol-2-yl)phenyl]-3,5-dinitro-benzamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-3,5-dinitro-benzamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-3,5-dinitro-benzamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-3,5-dinitrobenzamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-3,5-dinitrobenzamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-3,5-dinitro-benzamide Formula: C20H12N4O5S MolecularWeight: 420.39808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC(=CC=C3)NC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC(=CC=C3)NC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

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