3-[[5-(3,4-dimethoxyphenyl)thieno[2,3-d]pyrimidin-4-yl]-methyl-amino]propanoate

Systemtic Name: 3-[[5-(3,4-dimethoxyphenyl)thieno[2,3-d]pyrimidin-4-yl]-methyl-amino]propanoate Openeye Name: 3-[[5-(3,4-dimethoxyphenyl)thieno[2,3-d]pyrimidin-4-yl]-methyl-amino]propanoate CAS Name: 3-[[5-(3,4-dimethoxyphenyl)-4-thieno[2,3-d]pyrimidinyl]-methylamino]propanoate IUPAC Name: 3-[[5-(3,4-dimethoxyphenyl)thieno[2,3-d]pyrimidin-4-yl]-methylamino]propanoate Traditional Name: 3-[[5-(3,4-dimethoxyphenyl)thieno[2,3-d]pyrimidin-4-yl]-methyl-amino]propionate Formula: C18H18N3O4S- MolecularWeight: 372.41822

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=O)[O-])C1=C2C(=CSC2=NC=N1)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CN(CCC(=O)[O-])C1=C2C(=CSC2=NC=N1)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C18H19N3O4S/c1-21(7-6-15(22)23)17-16-12(9-26-18(16)20-10-19-17)11-4-5-13(24-2)14(8-11)25-3/h4-5,8-10H,6-7H2,1-3H3,(H,22,23)/p-1