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3-[(5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)methylazaniumyl]propyl-diethyl-azanium

3-[(5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)methylazaniumyl]propyl-diethyl-azanium

Systemtic Name:3-[(5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)methylazaniumyl]propyl-diethyl-azanium
Openeye Name:3-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methylammonio]propyl-diethyl-ammonium
CAS Name:3-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methylammonio]propyl-diethylammonium
IUPAC Name:3-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methylazaniumyl]propyl-diethylazanium
Traditional Name:diethyl-[3-[(4-keto-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylammonio]propyl]ammonium
Formula: C16H28N4OS+2
MolecularWeight: 324.48472
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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCC[NH2+]CC1=NC2=C(C(=C(S2)C)C)C(=O)N1


Isomeric SMILES

CC[NH+](CC)CCC[NH2+]CC1=NC2=C(C(=C(S2)C)C)C(=O)N1


InChI

InChI=1S/C16H26N4OS/c1-5-20(6-2)9-7-8-17-10-13-18-15(21)14-11(3)12(4)22-16(14)19-13/h17H,5-10H2,1-4H3,(H,18,19,21)/p+2


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