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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2C(=CSC2=N1)C3=CC=C(C=C3)Cl)NCCC(=O)[O-]

Isomeric SMILES

CC1=NC(=C2C(=CSC2=N1)C3=CC=C(C=C3)Cl)NCCC(=O)[O-]

InChI

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