5-(2-methyl-3,5-dinitro-phenyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-(2-methyl-3,5-dinitro-phenyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-(2-methyl-3,5-dinitro-phenyl)-1,3,4-thiadiazol-2-amine CAS Name: 5-(2-methyl-3,5-dinitrophenyl)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-(2-methyl-3,5-dinitrophenyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-(2-methyl-3,5-dinitro-phenyl)-1,3,4-thiadiazol-2-yl]amine Formula: C9H7N5O4S MolecularWeight: 281.24798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1C2=NN=C(S2)N)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1C2=NN=C(S2)N)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H7N5O4S/c1-4-6(8-11-12-9(10)19-8)2-5(13(15)16)3-7(4)14(17)18/h2-3H,1H3,(H2,10,12)