4-[2-azanyl-6-[3-(methylamino)azetidin-1-yl]pyrimidin-4-yl]benzenecarbonitrile

Systemtic Name: 4-[2-azanyl-6-[3-(methylamino)azetidin-1-yl]pyrimidin-4-yl]benzenecarbonitrile Openeye Name: 4-[2-amino-6-[3-(methylamino)azetidin-1-yl]pyrimidin-4-yl]benzonitrile CAS Name: 4-[2-amino-6-[3-(methylamino)-1-azetidinyl]-4-pyrimidinyl]benzonitrile IUPAC Name: 4-[2-amino-6-[3-(methylamino)azetidin-1-yl]pyrimidin-4-yl]benzonitrile Traditional Name: 4-[2-amino-6-[3-(methylamino)azetidin-1-yl]pyrimidin-4-yl]benzonitrile Formula: C15H16N6 MolecularWeight: 280.32774

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Descriptors Computed from Structure

Canonical SMILES:

CNC1CN(C1)C2=NC(=NC(=C2)C3=CC=C(C=C3)C#N)N

Isomeric SMILES

CNC1CN(C1)C2=NC(=NC(=C2)C3=CC=C(C=C3)C#N)N

InChI

InChI=1S/C15H16N6/c1-18-12-8-21(9-12)14-6-13(19-15(17)20-14)11-4-2-10(7-16)3-5-11/h2-6,12,18H,8-9H2,1H3,(H2,17,19,20)