5-nitro-2-(1,2,3-thiadiazol-4-ylmethylamino)benzenecarbonitrile

Systemtic Name: 5-nitro-2-(1,2,3-thiadiazol-4-ylmethylamino)benzenecarbonitrile Openeye Name: 5-nitro-2-(thiadiazol-4-ylmethylamino)benzonitrile CAS Name: 5-nitro-2-(4-thiadiazolylmethylamino)benzonitrile IUPAC Name: 5-nitro-2-(thiadiazol-4-ylmethylamino)benzonitrile Traditional Name: 5-nitro-2-(thiadiazol-4-ylmethylamino)benzonitrile Formula: C10H7N5O2S MolecularWeight: 261.25988

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])C#N)NCC2=CSN=N2

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])C#N)NCC2=CSN=N2

InChI

InChI=1S/C10H7N5O2S/c11-4-7-3-9(15(16)17)1-2-10(7)12-5-8-6-18-14-13-8/h1-3,6,12H,5H2