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

Systemtic Name: 3-(4-azanyl-6-morpholin-4-ylcarbonyl-thieno[2,3-d]pyrimidin-2-yl)benzenecarbonitrile Openeye Name: 3-[4-amino-6-(morpholine-4-carbonyl)thieno[2,3-d]pyrimidin-2-yl]benzonitrile CAS Name: 3-[4-amino-6-[4-morpholinyl(oxo)methyl]-2-thieno[2,3-d]pyrimidinyl]benzonitrile IUPAC Name: 3-[4-amino-6-(morpholine-4-carbonyl)thieno[2,3-d]pyrimidin-2-yl]benzonitrile Traditional Name: 3-[4-amino-6-(morpholine-4-carbonyl)thieno[2,3-d]pyrimidin-2-yl]benzonitrile Formula: C18H15N5O2S MolecularWeight: 365.409

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C2=CC3=C(N=C(N=C3S2)C4=CC=CC(=C4)C#N)N

Isomeric SMILES

C1COCCN1C(=O)C2=CC3=C(N=C(N=C3S2)C4=CC=CC(=C4)C#N)N

InChI

InChI=1S/C18H15N5O2S/c19-10-11-2-1-3-12(8-11)16-21-15(20)13-9-14(26-17(13)22-16)18(24)23-4-6-25-7-5-23/h1-3,8-9H,4-7H2,(H2,20,21,22)