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

Systemtic Name: methyl 4-[(5-phenyl-2-pyridin-2-yl-thieno[2,3-d]pyrimidin-4-yl)amino]butanoate Openeye Name: methyl 4-[[5-phenyl-2-(2-pyridyl)thieno[2,3-d]pyrimidin-4-yl]amino]butanoate CAS Name: 4-[[5-phenyl-2-(2-pyridinyl)-4-thieno[2,3-d]pyrimidinyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[(5-phenyl-2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)amino]butanoate Traditional Name: 4-[[5-phenyl-2-(2-pyridyl)thieno[2,3-d]pyrimidin-4-yl]amino]butyric acid methyl ester Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC1=C2C(=CSC2=NC(=N1)C3=CC=CC=N3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)CCCNC1=C2C(=CSC2=NC(=N1)C3=CC=CC=N3)C4=CC=CC=C4

InChI

InChI=1S/C22H20N4O2S/c1-28-18(27)11-7-13-24-21-19-16(15-8-3-2-4-9-15)14-29-22(19)26-20(25-21)17-10-5-6-12-23-17/h2-6,8-10,12,14H,7,11,13H2,1H3,(H,24,25,26)