2-[4-(bromomethyl)phenyl]-5-(3-nitrophenyl)-1,3,4-thiadiazole

Systemtic Name: 2-[4-(bromomethyl)phenyl]-5-(3-nitrophenyl)-1,3,4-thiadiazole Openeye Name: 2-[4-(bromomethyl)phenyl]-5-(3-nitrophenyl)-1,3,4-thiadiazole CAS Name: 2-[4-(bromomethyl)phenyl]-5-(3-nitrophenyl)-1,3,4-thiadiazole IUPAC Name: 2-[4-(bromomethyl)phenyl]-5-(3-nitrophenyl)-1,3,4-thiadiazole Traditional Name: 2-[4-(bromomethyl)phenyl]-5-(3-nitrophenyl)-1,3,4-thiadiazole Formula: C15H10BrN3O2S MolecularWeight: 376.2278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=NN=C(S2)C3=CC=C(C=C3)CBr

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=NN=C(S2)C3=CC=C(C=C3)CBr

InChI

InChI=1S/C15H10BrN3O2S/c16-9-10-4-6-11(7-5-10)14-17-18-15(22-14)12-2-1-3-13(8-12)19(20)21/h1-8H,9H2