5-[4-(1H-benzimidazol-2-ylamino)-3-nitro-phenyl]-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[4-(1H-benzimidazol-2-ylamino)-3-nitro-phenyl]-1,3,4-thiadiazol-2-amine Openeye Name: 5-[4-(1H-benzimidazol-2-ylamino)-3-nitro-phenyl]-1,3,4-thiadiazol-2-amine CAS Name: 5-[4-(1H-benzimidazol-2-ylamino)-3-nitrophenyl]-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[4-(1H-benzimidazol-2-ylamino)-3-nitrophenyl]-1,3,4-thiadiazol-2-amine Traditional Name: [4-(5-amino-1,3,4-thiadiazol-2-yl)-2-nitro-phenyl]-(1H-benzimidazol-2-yl)amine Formula: C15H11N7O2S MolecularWeight: 353.35854

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)NC3=C(C=C(C=C3)C4=NN=C(S4)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)NC3=C(C=C(C=C3)C4=NN=C(S4)N)[N+](=O)[O-]

InChI

InChI=1S/C15H11N7O2S/c16-14-21-20-13(25-14)8-5-6-11(12(7-8)22(23)24)19-15-17-9-3-1-2-4-10(9)18-15/h1-7H,(H2,16,21)(H2,17,18,19)