4-nitro-N-(3-phenylpropyl)-2,1,3-benzothiadiazol-5-amine

Systemtic Name: 4-nitro-N-(3-phenylpropyl)-2,1,3-benzothiadiazol-5-amine Openeye Name: 4-nitro-N-(3-phenylpropyl)-2,1,3-benzothiadiazol-5-amine CAS Name: 4-nitro-N-(3-phenylpropyl)-2,1,3-benzothiadiazol-5-amine IUPAC Name: 4-nitro-N-(3-phenylpropyl)-2,1,3-benzothiadiazol-5-amine Traditional Name: (4-nitropiazthiol-5-yl)-(3-phenylpropyl)amine Formula: C15H14N4O2S MolecularWeight: 314.36226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNC2=C(C3=NSN=C3C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCCNC2=C(C3=NSN=C3C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H14N4O2S/c20-19(21)15-13(9-8-12-14(15)18-22-17-12)16-10-4-7-11-5-2-1-3-6-11/h1-3,5-6,8-9,16H,4,7,10H2