4-methyl-3,5-dinitro-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)benzamide

Systemtic Name: 4-methyl-3,5-dinitro-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-4-methyl-3,5-dinitro-benzamide CAS Name: 4-methyl-3,5-dinitro-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)benzamide IUPAC Name: 4-methyl-3,5-dinitro-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-4-methyl-3,5-dinitro-benzamide Formula: C13H13N5O5S MolecularWeight: 351.33782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)NC2=NN=C(S2)C(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)NC2=NN=C(S2)C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C13H13N5O5S/c1-6(2)12-15-16-13(24-12)14-11(19)8-4-9(17(20)21)7(3)10(5-8)18(22)23/h4-6H,1-3H3,(H,14,16,19)