N-[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]-3,5-dinitro-benzamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]-3,5-dinitro-benzamide Openeye Name: N-[4-(1,3-benzothiazol-2-yl)thiazol-2-yl]-3,5-dinitro-benzamide CAS Name: N-[4-(1,3-benzothiazol-2-yl)-2-thiazolyl]-3,5-dinitrobenzamide IUPAC Name: N-[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]-3,5-dinitrobenzamide Traditional Name: N-[4-(1,3-benzothiazol-2-yl)thiazol-2-yl]-3,5-dinitro-benzamide Formula: C17H9N5O5S2 MolecularWeight: 427.41386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CSC(=N3)NC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CSC(=N3)NC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H9N5O5S2/c23-15(9-5-10(21(24)25)7-11(6-9)22(26)27)20-17-19-13(8-28-17)16-18-12-3-1-2-4-14(12)29-16/h1-8H,(H,19,20,23)