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

Systemtic Name: 3-azanyl-5-[3-[methyl-(2-pyridin-4-ylquinazolin-4-yl)amino]propyl]-1H-pyrazole-4-carbonitrile Openeye Name: 3-amino-5-[3-[methyl-[2-(4-pyridyl)quinazolin-4-yl]amino]propyl]-1H-pyrazole-4-carbonitrile CAS Name: 3-amino-5-[3-[methyl-(2-pyridin-4-yl-4-quinazolinyl)amino]propyl]-1H-pyrazole-4-carbonitrile IUPAC Name: 3-amino-5-[3-[methyl-(2-pyridin-4-ylquinazolin-4-yl)amino]propyl]-1H-pyrazole-4-carbonitrile Traditional Name: 3-amino-5-[3-[methyl-[2-(4-pyridyl)quinazolin-4-yl]amino]propyl]-1H-pyrazole-4-carbonitrile Formula: C21H20N8 MolecularWeight: 384.4371

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC1=C(C(=NN1)N)C#N)C2=NC(=NC3=CC=CC=C32)C4=CC=NC=C4

Isomeric SMILES

CN(CCCC1=C(C(=NN1)N)C#N)C2=NC(=NC3=CC=CC=C32)C4=CC=NC=C4

InChI

InChI=1S/C21H20N8/c1-29(12-4-7-18-16(13-22)19(23)28-27-18)21-15-5-2-3-6-17(15)25-20(26-21)14-8-10-24-11-9-14/h2-3,5-6,8-11H,4,7,12H2,1H3,(H3,23,27,28)