3-nitro-N-(1,2,3-thiadiazol-4-ylmethyl)aniline

Systemtic Name: 3-nitro-N-(1,2,3-thiadiazol-4-ylmethyl)aniline Openeye Name: 3-nitro-N-(thiadiazol-4-ylmethyl)aniline CAS Name: 3-nitro-N-(4-thiadiazolylmethyl)aniline IUPAC Name: 3-nitro-N-(thiadiazol-4-ylmethyl)aniline Traditional Name: (3-nitrophenyl)-(thiadiazol-4-ylmethyl)amine Formula: C9H8N4O2S MolecularWeight: 236.25042

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8N4O2S/c14-13(15)9-3-1-2-7(4-9)10-5-8-6-16-12-11-8/h1-4,6,10H,5H2