2-methylsulfanyl-1,4-dihydroquinazolin-3-ium iodide

Systemtic Name: 2-methylsulfanyl-1,4-dihydroquinazolin-3-ium iodide Openeye Name: 2-methylsulfanyl-1,4-dihydroquinazolin-3-ium iodide CAS Name: 2-(methylthio)-1,4-dihydroquinazolin-3-ium iodide IUPAC Name: 2-methylsulfanyl-1,4-dihydroquinazolin-3-ium iodide Traditional Name: 2-(methylthio)-1,4-dihydroquinazolin-3-ium iodide Formula: C9H11IN2S MolecularWeight: 306.16651

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=[NH+]CC2=CC=CC=C2N1.[I-]

Isomeric SMILES

CSC1=[NH+]CC2=CC=CC=C2N1.[I-]

InChI

InChI=1S/C9H10N2S.HI/c1-12-9-10-6-7-4-2-3-5-8(7)11-9;/h2-5H,6H2,1H3,(H,10,11);1H