5-[(2-chloranyl-4-nitro-phenoxy)methyl]-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(2-chloranyl-4-nitro-phenoxy)methyl]-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(2-chloro-4-nitro-phenoxy)methyl]-1,3,4-thiadiazol-2-amine CAS Name: 5-[(2-chloro-4-nitrophenoxy)methyl]-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(2-chloro-4-nitrophenoxy)methyl]-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(2-chloro-4-nitro-phenoxy)methyl]-1,3,4-thiadiazol-2-yl]amine Formula: C9H7ClN4O3S MolecularWeight: 286.69488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])Cl)OCC2=NN=C(S2)N

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])Cl)OCC2=NN=C(S2)N

InChI

InChI=1S/C9H7ClN4O3S/c10-6-3-5(14(15)16)1-2-7(6)17-4-8-12-13-9(11)18-8/h1-3H,4H2,(H2,11,13)