methyl 4-[(phenylmethyl)amino]-2-pyridin-3-yl-quinazoline-6-carboxylate

Systemtic Name: methyl 4-[(phenylmethyl)amino]-2-pyridin-3-yl-quinazoline-6-carboxylate Openeye Name: methyl 4-(benzylamino)-2-(3-pyridyl)quinazoline-6-carboxylate CAS Name: 4-[(phenylmethyl)amino]-2-(3-pyridinyl)-6-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 4-(benzylamino)-2-pyridin-3-ylquinazoline-6-carboxylate Traditional Name: 4-(benzylamino)-2-(3-pyridyl)quinazoline-6-carboxylic acid methyl ester Formula: C22H18N4O2 MolecularWeight: 370.40392

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18N4O2/c1-28-22(27)16-9-10-19-18(12-16)21(24-13-15-6-3-2-4-7-15)26-20(25-19)17-8-5-11-23-14-17/h2-12,14H,13H2,1H3,(H,24,25,26)