[5,6-dimethyl-4-(2-oxidanylidenechromen-7-yl)oxy-thieno[2,3-d]pyrimidin-2-yl]methyl-diethyl-azanium

Systemtic Name: [5,6-dimethyl-4-(2-oxidanylidenechromen-7-yl)oxy-thieno[2,3-d]pyrimidin-2-yl]methyl-diethyl-azanium Openeye Name: [5,6-dimethyl-4-(2-oxochromen-7-yl)oxy-thieno[2,3-d]pyrimidin-2-yl]methyl-diethyl-ammonium CAS Name: [5,6-dimethyl-4-[(2-oxo-1-benzopyran-7-yl)oxy]-2-thieno[2,3-d]pyrimidinyl]methyl-diethylammonium IUPAC Name: [5,6-dimethyl-4-(2-oxochromen-7-yl)oxythieno[2,3-d]pyrimidin-2-yl]methyl-diethylazanium Traditional Name: diethyl-[[4-(2-ketochromen-7-yl)oxy-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl]methyl]ammonium Formula: C22H24N3O3S+ MolecularWeight: 410.50926

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=NC(=C2C(=C(SC2=N1)C)C)OC3=CC4=C(C=C3)C=CC(=O)O4

Isomeric SMILES

CC[NH+](CC)CC1=NC(=C2C(=C(SC2=N1)C)C)OC3=CC4=C(C=C3)C=CC(=O)O4

InChI

InChI=1S/C22H23N3O3S/c1-5-25(6-2)12-18-23-21(20-13(3)14(4)29-22(20)24-18)27-16-9-7-15-8-10-19(26)28-17(15)11-16/h7-11H,5-6,12H2,1-4H3/p+1