1-[4-[(phenylmethyl)amino]-2-pyridin-3-yl-quinazolin-6-yl]ethanone

Systemtic Name: 1-[4-[(phenylmethyl)amino]-2-pyridin-3-yl-quinazolin-6-yl]ethanone Openeye Name: 1-[4-(benzylamino)-2-(3-pyridyl)quinazolin-6-yl]ethanone CAS Name: 1-[4-[(phenylmethyl)amino]-2-(3-pyridinyl)-6-quinazolinyl]ethanone IUPAC Name: 1-[4-(benzylamino)-2-pyridin-3-ylquinazolin-6-yl]ethanone Traditional Name: 1-[4-(benzylamino)-2-(3-pyridyl)quinazolin-6-yl]ethanone Formula: C22H18N4O MolecularWeight: 354.40452

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)N=C(N=C2NCC3=CC=CC=C3)C4=CN=CC=C4

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)N=C(N=C2NCC3=CC=CC=C3)C4=CN=CC=C4

InChI

InChI=1S/C22H18N4O/c1-15(27)17-9-10-20-19(12-17)22(24-13-16-6-3-2-4-7-16)26-21(25-20)18-8-5-11-23-14-18/h2-12,14H,13H2,1H3,(H,24,25,26)