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

Systemtic Name: 3-[[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]propanoate Openeye Name: 3-[[5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]amino]propanoate CAS Name: 3-[[5-(4-methylphenyl)-4-thieno[2,3-d]pyrimidinyl]amino]propanoate IUPAC Name: 3-[[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]propanoate Traditional Name: 3-[[5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]amino]propionate Formula: C16H14N3O2S- MolecularWeight: 312.36626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)NCCC(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)NCCC(=O)[O-]

InChI

InChI=1S/C16H15N3O2S/c1-10-2-4-11(5-3-10)12-8-22-16-14(12)15(18-9-19-16)17-7-6-13(20)21/h2-5,8-9H,6-7H2,1H3,(H,20,21)(H,17,18,19)/p-1