2,4-bis(azanyl)quinazoline-6-sulfonyl chloride sulfate

Systemtic Name: 2,4-bis(azanyl)quinazoline-6-sulfonyl chloride sulfate Openeye Name: 2,4-diaminoquinazoline-6-sulfonyl chloride sulfate CAS Name: 2,4-diamino-6-quinazolinesulfonyl chloride sulfate IUPAC Name: 2,4-diaminoquinazoline-6-sulfonyl chloride sulfate Traditional Name: 2,4-diaminoquinazoline-6-sulfonyl chloride sulfate Formula: C8H7ClN4O6S2-2 MolecularWeight: 354.74738

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1S(=O)(=O)Cl)C(=NC(=N2)N)N.[O-]S(=O)(=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1S(=O)(=O)Cl)C(=NC(=N2)N)N.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C8H7ClN4O2S.H2O4S/c9-16(14,15)4-1-2-6-5(3-4)7(10)13-8(11)12-6;1-5(2,3)4/h1-3H,(H4,10,11,12,13);(H2,1,2,3,4)/p-2