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

Systemtic Name: [4-(4-ethanoylphenoxy)-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl]methyl-diethyl-azanium Openeye Name: [4-(4-acetylphenoxy)-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl]methyl-diethyl-ammonium CAS Name: [4-(4-acetylphenoxy)-5,6-dimethyl-2-thieno[2,3-d]pyrimidinyl]methyl-diethylammonium IUPAC Name: [4-(4-acetylphenoxy)-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl]methyl-diethylazanium Traditional Name: [4-(4-acetylphenoxy)-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl]methyl-diethyl-ammonium Formula: C21H26N3O2S+ MolecularWeight: 384.51504

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=NC(=C2C(=C(SC2=N1)C)C)OC3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC[NH+](CC)CC1=NC(=C2C(=C(SC2=N1)C)C)OC3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C21H25N3O2S/c1-6-24(7-2)12-18-22-20(19-13(3)15(5)27-21(19)23-18)26-17-10-8-16(9-11-17)14(4)25/h8-11H,6-7,12H2,1-5H3/p+1