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

Systemtic Name: 3-[[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]-methyl-amino]propanoate Openeye Name: 3-[[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]-methyl-amino]propanoate CAS Name: 3-[[5-(4-chlorophenyl)-4-thieno[2,3-d]pyrimidinyl]-methylamino]propanoate IUPAC Name: 3-[[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]-methylamino]propanoate Traditional Name: 3-[[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]-methyl-amino]propionate Formula: C16H13ClN3O2S- MolecularWeight: 346.81132

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14ClN3O2S/c1-20(7-6-13(21)22)15-14-12(8-23-16(14)19-9-18-15)10-2-4-11(17)5-3-10/h2-5,8-9H,6-7H2,1H3,(H,21,22)/p-1