3-[4-azanyl-6-(2-methoxypyridin-3-yl)carbonyl-thieno[2,3-d]pyrimidin-2-yl]benzenecarbonitrile

Systemtic Name: 3-[4-azanyl-6-(2-methoxypyridin-3-yl)carbonyl-thieno[2,3-d]pyrimidin-2-yl]benzenecarbonitrile Openeye Name: 3-[4-amino-6-(2-methoxypyridine-3-carbonyl)thieno[2,3-d]pyrimidin-2-yl]benzonitrile CAS Name: 3-[4-amino-6-[(2-methoxy-3-pyridinyl)-oxomethyl]-2-thieno[2,3-d]pyrimidinyl]benzonitrile IUPAC Name: 3-[4-amino-6-(2-methoxypyridine-3-carbonyl)thieno[2,3-d]pyrimidin-2-yl]benzonitrile Traditional Name: 3-[4-amino-6-(2-methoxynicotinoyl)thieno[2,3-d]pyrimidin-2-yl]benzonitrile Formula: C20H13N5O2S MolecularWeight: 387.41452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC=N1)C(=O)C2=CC3=C(N=C(N=C3S2)C4=CC=CC(=C4)C#N)N

Isomeric SMILES

COC1=C(C=CC=N1)C(=O)C2=CC3=C(N=C(N=C3S2)C4=CC=CC(=C4)C#N)N

InChI

InChI=1S/C20H13N5O2S/c1-27-19-13(6-3-7-23-19)16(26)15-9-14-17(22)24-18(25-20(14)28-15)12-5-2-4-11(8-12)10-21/h2-9H,1H3,(H2,22,24,25)