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

Systemtic Name: methyl 4-[(phenylmethyl)amino]-2-pyridin-4-yl-quinazoline-6-carboxylate Openeye Name: methyl 4-(benzylamino)-2-(4-pyridyl)quinazoline-6-carboxylate CAS Name: 4-[(phenylmethyl)amino]-2-pyridin-4-yl-6-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 4-(benzylamino)-2-pyridin-4-ylquinazoline-6-carboxylate Traditional Name: 4-(benzylamino)-2-(4-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=CC=NC=C4

Isomeric SMILES

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

InChI

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