N-(3-fluorophenyl)-5-(8-nitroisoquinolin-5-yl)sulfanyl-1,3,4-thiadiazol-2-amine

Systemtic Name: N-(3-fluorophenyl)-5-(8-nitroisoquinolin-5-yl)sulfanyl-1,3,4-thiadiazol-2-amine Openeye Name: N-(3-fluorophenyl)-5-[(8-nitro-5-isoquinolyl)sulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: N-(3-fluorophenyl)-5-[(8-nitro-5-isoquinolinyl)thio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-(3-fluorophenyl)-5-(8-nitroisoquinolin-5-yl)sulfanyl-1,3,4-thiadiazol-2-amine Traditional Name: (3-fluorophenyl)-[5-[(8-nitro-5-isoquinolyl)thio]-1,3,4-thiadiazol-2-yl]amine Formula: C17H10FN5O2S2 MolecularWeight: 399.422003

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)NC2=NN=C(S2)SC3=C4C=CN=CC4=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)F)NC2=NN=C(S2)SC3=C4C=CN=CC4=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H10FN5O2S2/c18-10-2-1-3-11(8-10)20-16-21-22-17(27-16)26-15-5-4-14(23(24)25)13-9-19-7-6-12(13)15/h1-9H,(H,20,21)