3-([1]benzofuro[3,2-d]pyrimidin-4-ylamino)benzenecarbonitrile

Systemtic Name: 3-([1]benzofuro[3,2-d]pyrimidin-4-ylamino)benzenecarbonitrile Openeye Name: 3-(benzofuro[3,2-d]pyrimidin-4-ylamino)benzonitrile CAS Name: 3-(4-benzofuro[3,2-d]pyrimidinylamino)benzonitrile IUPAC Name: 3-([1]benzofuro[3,2-d]pyrimidin-4-ylamino)benzonitrile Traditional Name: 3-(benzofuro[3,2-d]pyrimidin-4-ylamino)benzonitrile Formula: C17H10N4O MolecularWeight: 286.2875

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(O2)C(=NC=N3)NC4=CC=CC(=C4)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(O2)C(=NC=N3)NC4=CC=CC(=C4)C#N

InChI

InChI=1S/C17H10N4O/c18-9-11-4-3-5-12(8-11)21-17-16-15(19-10-20-17)13-6-1-2-7-14(13)22-16/h1-8,10H,(H,19,20,21)