methyl 4-[2-(diethylaminomethyl)-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl]oxybenzoate

Systemtic Name: methyl 4-[2-(diethylaminomethyl)-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl]oxybenzoate Openeye Name: methyl 4-[2-(diethylaminomethyl)-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl]oxybenzoate CAS Name: 4-[[2-(diethylaminomethyl)-5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl]oxy]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(diethylaminomethyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-yl]oxybenzoate Traditional Name: 4-[2-(diethylaminomethyl)-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl]oxybenzoic acid methyl ester Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=NC(=C2C(=C(SC2=N1)C)C)OC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCN(CC)CC1=NC(=C2C(=C(SC2=N1)C)C)OC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C21H25N3O3S/c1-6-24(7-2)12-17-22-19(18-13(3)14(4)28-20(18)23-17)27-16-10-8-15(9-11-16)21(25)26-5/h8-11H,6-7,12H2,1-5H3