methyl 4-[[4-[(phenylmethyl)amino]quinazolin-2-yl]amino]benzoate

Systemtic Name: methyl 4-[[4-[(phenylmethyl)amino]quinazolin-2-yl]amino]benzoate Openeye Name: methyl 4-[[4-(benzylamino)quinazolin-2-yl]amino]benzoate CAS Name: 4-[[4-[(phenylmethyl)amino]-2-quinazolinyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-(benzylamino)quinazolin-2-yl]amino]benzoate Traditional Name: 4-[[4-(benzylamino)quinazolin-2-yl]amino]benzoic acid methyl ester Formula: C23H20N4O2 MolecularWeight: 384.4305

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC2=NC3=CC=CC=C3C(=N2)NCC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC2=NC3=CC=CC=C3C(=N2)NCC4=CC=CC=C4

InChI

InChI=1S/C23H20N4O2/c1-29-22(28)17-11-13-18(14-12-17)25-23-26-20-10-6-5-9-19(20)21(27-23)24-15-16-7-3-2-4-8-16/h2-14H,15H2,1H3,(H2,24,25,26,27)