3-azanyl-5-[3-[(2-pyridin-4-ylquinazolin-4-yl)amino]propyl]-1H-pyrazole-4-carbonitrile

Systemtic Name: 3-azanyl-5-[3-[(2-pyridin-4-ylquinazolin-4-yl)amino]propyl]-1H-pyrazole-4-carbonitrile Openeye Name: 3-amino-5-[3-[[2-(4-pyridyl)quinazolin-4-yl]amino]propyl]-1H-pyrazole-4-carbonitrile CAS Name: 3-amino-5-[3-[(2-pyridin-4-yl-4-quinazolinyl)amino]propyl]-1H-pyrazole-4-carbonitrile IUPAC Name: 3-amino-5-[3-[(2-pyridin-4-ylquinazolin-4-yl)amino]propyl]-1H-pyrazole-4-carbonitrile Traditional Name: 3-amino-5-[3-[[2-(4-pyridyl)quinazolin-4-yl]amino]propyl]-1H-pyrazole-4-carbonitrile Formula: C20H18N8 MolecularWeight: 370.41052

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=NC=C3)NCCCC4=C(C(=NN4)N)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=NC=C3)NCCCC4=C(C(=NN4)N)C#N

InChI

InChI=1S/C20H18N8/c21-12-15-17(27-28-18(15)22)6-3-9-24-20-14-4-1-2-5-16(14)25-19(26-20)13-7-10-23-11-8-13/h1-2,4-5,7-8,10-11H,3,6,9H2,(H3,22,27,28)(H,24,25,26)