(6-ethylthieno[2,3-d]pyrimidin-1-ium-4-yl)-(4-methylphenyl)azanium dichloride

Systemtic Name: (6-ethylthieno[2,3-d]pyrimidin-1-ium-4-yl)-(4-methylphenyl)azanium dichloride Openeye Name: (6-ethylthieno[2,3-d]pyrimidin-1-ium-4-yl)-(p-tolyl)ammonium dichloride CAS Name: (6-ethyl-4-thieno[2,3-d]pyrimidin-1-iumyl)-(4-methylphenyl)ammonium dichloride IUPAC Name: (6-ethylthieno[2,3-d]pyrimidin-1-ium-4-yl)-(4-methylphenyl)azanium dichloride Traditional Name: (6-ethylthieno[2,3-d]pyrimidin-1-ium-4-yl)-(p-tolyl)ammonium dichloride Formula: C15H17Cl2N3S MolecularWeight: 342.28658

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=C[NH+]=C2S1)[NH2+]C3=CC=C(C=C3)C.[Cl-].[Cl-]

Isomeric SMILES

CCC1=CC2=C(N=C[NH+]=C2S1)[NH2+]C3=CC=C(C=C3)C.[Cl-].[Cl-]

InChI

InChI=1S/C15H15N3S.2ClH/c1-3-12-8-13-14(16-9-17-15(13)19-12)18-11-6-4-10(2)5-7-11;;/h4-9H,3H2,1-2H3,(H,16,17,18);2*1H