4-[[5,6-dimethyl-4-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-thieno[2,3-d]pyrimidin-2-yl]methyl]morpholin-4-ium

Systemtic Name: 4-[[5,6-dimethyl-4-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-thieno[2,3-d]pyrimidin-2-yl]methyl]morpholin-4-ium Openeye Name: 4-[[5,6-dimethyl-4-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-thieno[2,3-d]pyrimidin-2-yl]methyl]morpholin-4-ium CAS Name: 4-[[5,6-dimethyl-4-[(4,5,6-trimethyl-2-pyrimidinyl)thio]-2-thieno[2,3-d]pyrimidinyl]methyl]morpholin-4-ium IUPAC Name: 4-[[5,6-dimethyl-4-(4,5,6-trimethylpyrimidin-2-yl)sulfanylthieno[2,3-d]pyrimidin-2-yl]methyl]morpholin-4-ium Traditional Name: 4-[[5,6-dimethyl-4-[(4,5,6-trimethylpyrimidin-2-yl)thio]thieno[2,3-d]pyrimidin-2-yl]methyl]morpholin-4-ium Formula: C20H26N5OS2+ MolecularWeight: 416.58334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1C)SC2=NC(=NC3=C2C(=C(S3)C)C)C[NH+]4CCOCC4)C

Isomeric SMILES

CC1=C(N=C(N=C1C)SC2=NC(=NC3=C2C(=C(S3)C)C)C[NH+]4CCOCC4)C

InChI

InChI=1S/C20H25N5OS2/c1-11-13(3)21-20(22-14(11)4)28-19-17-12(2)15(5)27-18(17)23-16(24-19)10-25-6-8-26-9-7-25/h6-10H2,1-5H3/p+1