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

Systemtic Name: 3,5-dinitro-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]benzamide Openeye Name: 3,5-dinitro-N-[(2-phenylthiazol-4-yl)methyl]benzamide CAS Name: 3,5-dinitro-N-[(2-phenyl-4-thiazolyl)methyl]benzamide IUPAC Name: 3,5-dinitro-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]benzamide Traditional Name: 3,5-dinitro-N-[(2-phenylthiazol-4-yl)methyl]benzamide Formula: C17H12N4O5S MolecularWeight: 384.36598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=CS2)CNC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=CS2)CNC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H12N4O5S/c22-16(12-6-14(20(23)24)8-15(7-12)21(25)26)18-9-13-10-27-17(19-13)11-4-2-1-3-5-11/h1-8,10H,9H2,(H,18,22)