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

Systemtic Name: methyl 3-[(5-phenyl-2-pyridin-3-yl-thieno[2,3-d]pyrimidin-4-yl)amino]propanoate Openeye Name: methyl 3-[[5-phenyl-2-(3-pyridyl)thieno[2,3-d]pyrimidin-4-yl]amino]propanoate CAS Name: 3-[[5-phenyl-2-(3-pyridinyl)-4-thieno[2,3-d]pyrimidinyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-[(5-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-yl)amino]propanoate Traditional Name: 3-[[5-phenyl-2-(3-pyridyl)thieno[2,3-d]pyrimidin-4-yl]amino]propionic acid methyl ester Formula: C21H18N4O2S MolecularWeight: 390.45822

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCNC1=C2C(=CSC2=NC(=N1)C3=CN=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)CCNC1=C2C(=CSC2=NC(=N1)C3=CN=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H18N4O2S/c1-27-17(26)9-11-23-20-18-16(14-6-3-2-4-7-14)13-28-21(18)25-19(24-20)15-8-5-10-22-12-15/h2-8,10,12-13H,9,11H2,1H3,(H,23,24,25)