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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CC1=C(N=C(S1)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C17H12N4O5S/c1-10-15(11-5-3-2-4-6-11)18-17(27-10)19-16(22)13-8-7-12(20(23)24)9-14(13)21(25)26/h2-9H,1H3,(H,18,19,22)