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

Systemtic Name: [4-(4-acetamidophenyl)sulfanyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl]methyl-diethyl-azanium Openeye Name: [4-(4-acetamidophenyl)sulfanyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl]methyl-diethyl-ammonium CAS Name: [4-[(4-acetamidophenyl)thio]-5,6-dimethyl-2-thieno[2,3-d]pyrimidinyl]methyl-diethylammonium IUPAC Name: [4-(4-acetamidophenyl)sulfanyl-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl]methyl-diethylazanium Traditional Name: [4-[(4-acetamidophenyl)thio]-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl]methyl-diethyl-ammonium Formula: C21H27N4OS2+ MolecularWeight: 415.59528

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=NC2=C(C(=C(S2)C)C)C(=N1)SC3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC[NH+](CC)CC1=NC2=C(C(=C(S2)C)C)C(=N1)SC3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C21H26N4OS2/c1-6-25(7-2)12-18-23-20-19(13(3)14(4)27-20)21(24-18)28-17-10-8-16(9-11-17)22-15(5)26/h8-11H,6-7,12H2,1-5H3,(H,22,26)/p+1