hydrogen sulfate; 1,3,4-trimethylquinazolin-1-ium-2-thione

Systemtic Name: hydrogen sulfate; 1,3,4-trimethylquinazolin-1-ium-2-thione Openeye Name: hydrogen sulfate; 1,3,4-trimethylquinazolin-1-ium-2-thione CAS Name: hydrogen sulfate; 1,3,4-trimethyl-2-quinazolin-1-iumthione IUPAC Name: hydrogen sulfate; 1,3,4-trimethylquinazolin-1-ium-2-thione Traditional Name: 1,3,4-trimethylquinazolin-1-ium-2-thione bisulfate Formula: C11H14N2O4S2 MolecularWeight: 302.36986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC=CC2=[N+](C(=S)N1C)C.OS(=O)(=O)[O-]

Isomeric SMILES

CC1=C2C=CC=CC2=[N+](C(=S)N1C)C.OS(=O)(=O)[O-]

InChI

InChI=1S/C11H13N2S.H2O4S/c1-8-9-6-4-5-7-10(9)13(3)11(14)12(8)2;1-5(2,3)4/h4-7H,1-3H3;(H2,1,2,3,4)/q+1;/p-1