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

Systemtic Name: 3-azanyl-5-[3-[methyl-(4-phenylquinazolin-2-yl)amino]propyl]-1H-pyrazole-4-carbonitrile Openeye Name: 3-amino-5-[3-[methyl-(4-phenylquinazolin-2-yl)amino]propyl]-1H-pyrazole-4-carbonitrile CAS Name: 3-amino-5-[3-[methyl-(4-phenyl-2-quinazolinyl)amino]propyl]-1H-pyrazole-4-carbonitrile IUPAC Name: 3-amino-5-[3-[methyl-(4-phenylquinazolin-2-yl)amino]propyl]-1H-pyrazole-4-carbonitrile Traditional Name: 3-amino-5-[3-[methyl-(4-phenylquinazolin-2-yl)amino]propyl]-1H-pyrazole-4-carbonitrile Formula: C22H21N7 MolecularWeight: 383.44904

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC1=C(C(=NN1)N)C#N)C2=NC3=CC=CC=C3C(=N2)C4=CC=CC=C4

Isomeric SMILES

CN(CCCC1=C(C(=NN1)N)C#N)C2=NC3=CC=CC=C3C(=N2)C4=CC=CC=C4

InChI

InChI=1S/C22H21N7/c1-29(13-7-12-19-17(14-23)21(24)28-27-19)22-25-18-11-6-5-10-16(18)20(26-22)15-8-3-2-4-9-15/h2-6,8-11H,7,12-13H2,1H3,(H3,24,27,28)