3,5-dinitro-N-(5-propan-2-yl-1,3-thiazol-2-yl)benzamide

Systemtic Name: 3,5-dinitro-N-(5-propan-2-yl-1,3-thiazol-2-yl)benzamide Openeye Name: N-(5-isopropylthiazol-2-yl)-3,5-dinitro-benzamide CAS Name: 3,5-dinitro-N-(5-propan-2-yl-2-thiazolyl)benzamide IUPAC Name: 3,5-dinitro-N-(5-propan-2-yl-1,3-thiazol-2-yl)benzamide Traditional Name: N-(5-isopropylthiazol-2-yl)-3,5-dinitro-benzamide Formula: C13H12N4O5S MolecularWeight: 336.32318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CN=C(S1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CN=C(S1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H12N4O5S/c1-7(2)11-6-14-13(23-11)15-12(18)8-3-9(16(19)20)5-10(4-8)17(21)22/h3-7H,1-2H3,(H,14,15,18)