N-[(E)-(3-methyl-1-phenyl-5-piperidin-1-yl-pyrazol-4-yl)methylideneamino]-2-pyridin-4-yl-quinazolin-4-amine

Systemtic Name: N-[(E)-(3-methyl-1-phenyl-5-piperidin-1-yl-pyrazol-4-yl)methylideneamino]-2-pyridin-4-yl-quinazolin-4-amine Openeye Name: N-[(E)-[3-methyl-1-phenyl-5-(1-piperidyl)pyrazol-4-yl]methyleneamino]-2-(4-pyridyl)quinazolin-4-amine CAS Name: N-[(E)-[3-methyl-1-phenyl-5-(1-piperidinyl)-4-pyrazolyl]methylideneamino]-2-pyridin-4-yl-4-quinazolinamine IUPAC Name: N-[(E)-(3-methyl-1-phenyl-5-piperidin-1-ylpyrazol-4-yl)methylideneamino]-2-pyridin-4-ylquinazolin-4-amine Traditional Name: [(E)-(3-methyl-1-phenyl-5-piperidino-pyrazol-4-yl)methyleneamino]-[2-(4-pyridyl)quinazolin-4-yl]amine Formula: C29H28N8 MolecularWeight: 488.58622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NNC2=NC(=NC3=CC=CC=C32)C4=CC=NC=C4)N5CCCCC5)C6=CC=CC=C6

Isomeric SMILES

CC1=NN(C(=C1/C=N/NC2=NC(=NC3=CC=CC=C32)C4=CC=NC=C4)N5CCCCC5)C6=CC=CC=C6

InChI

InChI=1S/C29H28N8/c1-21-25(29(36-18-8-3-9-19-36)37(35-21)23-10-4-2-5-11-23)20-31-34-28-24-12-6-7-13-26(24)32-27(33-28)22-14-16-30-17-15-22/h2,4-7,10-17,20H,3,8-9,18-19H2,1H3,(H,32,33,34)/b31-20+