[5,6-dimethyl-4-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]thieno[2,3-d]pyrimidin-2-yl]methyl-diethyl-azanium

Systemtic Name: [5,6-dimethyl-4-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]thieno[2,3-d]pyrimidin-2-yl]methyl-diethyl-azanium Openeye Name: [5,6-dimethyl-4-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]thieno[2,3-d]pyrimidin-2-yl]methyl-diethyl-ammonium CAS Name: [5,6-dimethyl-4-[(6-oxo-1H-pyrimidin-2-yl)thio]-2-thieno[2,3-d]pyrimidinyl]methyl-diethylammonium IUPAC Name: [5,6-dimethyl-4-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]thieno[2,3-d]pyrimidin-2-yl]methyl-diethylazanium Traditional Name: diethyl-[[4-[(6-keto-1H-pyrimidin-2-yl)thio]-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl]methyl]ammonium Formula: C17H22N5OS2+ MolecularWeight: 376.51948

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=NC2=C(C(=C(S2)C)C)C(=N1)SC3=NC=CC(=O)N3

Isomeric SMILES

CC[NH+](CC)CC1=NC2=C(C(=C(S2)C)C)C(=N1)SC3=NC=CC(=O)N3

InChI

InChI=1S/C17H21N5OS2/c1-5-22(6-2)9-12-19-15-14(10(3)11(4)24-15)16(20-12)25-17-18-8-7-13(23)21-17/h7-8H,5-6,9H2,1-4H3,(H,18,21,23)/p+1