N-[2-(1H-azepin-2-yl)ethyl]-6-ethynyl-2-pyridin-3-yl-quinazolin-4-amine

Systemtic Name: N-[2-(1H-azepin-2-yl)ethyl]-6-ethynyl-2-pyridin-3-yl-quinazolin-4-amine Openeye Name: N-[2-(1H-azepin-2-yl)ethyl]-6-ethynyl-2-(3-pyridyl)quinazolin-4-amine CAS Name: N-[2-(1H-azepin-2-yl)ethyl]-6-ethynyl-2-(3-pyridinyl)-4-quinazolinamine IUPAC Name: N-[2-(1H-azepin-2-yl)ethyl]-6-ethynyl-2-pyridin-3-ylquinazolin-4-amine Traditional Name: 2-(1H-azepin-2-yl)ethyl-[6-ethynyl-2-(3-pyridyl)quinazolin-4-yl]amine Formula: C23H19N5 MolecularWeight: 365.43046

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC2=C(C=C1)N=C(N=C2NCCC3=CC=CC=CN3)C4=CN=CC=C4

Isomeric SMILES

C#CC1=CC2=C(C=C1)N=C(N=C2NCCC3=CC=CC=CN3)C4=CN=CC=C4

InChI

InChI=1S/C23H19N5/c1-2-17-9-10-21-20(15-17)23(26-14-11-19-8-4-3-5-13-25-19)28-22(27-21)18-7-6-12-24-16-18/h1,3-10,12-13,15-16,25H,11,14H2,(H,26,27,28)