3-[4-azanyl-6-[(2-morpholin-4-ylpyridin-3-yl)methyl]thieno[2,3-d]pyrimidin-2-yl]benzenecarbonitrile

Systemtic Name: 3-[4-azanyl-6-[(2-morpholin-4-ylpyridin-3-yl)methyl]thieno[2,3-d]pyrimidin-2-yl]benzenecarbonitrile Openeye Name: 3-[4-amino-6-[(2-morpholino-3-pyridyl)methyl]thieno[2,3-d]pyrimidin-2-yl]benzonitrile CAS Name: 3-[4-amino-6-[[2-(4-morpholinyl)-3-pyridinyl]methyl]-2-thieno[2,3-d]pyrimidinyl]benzonitrile IUPAC Name: 3-[4-amino-6-[(2-morpholin-4-ylpyridin-3-yl)methyl]thieno[2,3-d]pyrimidin-2-yl]benzonitrile Traditional Name: 3-[4-amino-6-[(2-morpholino-3-pyridyl)methyl]thieno[2,3-d]pyrimidin-2-yl]benzonitrile Formula: C23H20N6OS MolecularWeight: 428.5095

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=CC=N2)CC3=CC4=C(N=C(N=C4S3)C5=CC=CC(=C5)C#N)N

Isomeric SMILES

C1COCCN1C2=C(C=CC=N2)CC3=CC4=C(N=C(N=C4S3)C5=CC=CC(=C5)C#N)N

InChI

InChI=1S/C23H20N6OS/c24-14-15-3-1-4-16(11-15)21-27-20(25)19-13-18(31-23(19)28-21)12-17-5-2-6-26-22(17)29-7-9-30-10-8-29/h1-6,11,13H,7-10,12H2,(H2,25,27,28)