N-[(3-methoxyphenyl)methyl]-4-[(4-morpholin-4-ylphenyl)amino]quinazoline-6-carboxamide

Systemtic Name: N-[(3-methoxyphenyl)methyl]-4-[(4-morpholin-4-ylphenyl)amino]quinazoline-6-carboxamide Openeye Name: N-[(3-methoxyphenyl)methyl]-4-(4-morpholinoanilino)quinazoline-6-carboxamide CAS Name: N-[(3-methoxyphenyl)methyl]-4-[4-(4-morpholinyl)anilino]-6-quinazolinecarboxamide IUPAC Name: N-[(3-methoxyphenyl)methyl]-4-(4-morpholin-4-ylanilino)quinazoline-6-carboxamide Traditional Name: N-m-anisyl-4-(4-morpholinoanilino)quinazoline-6-carboxamide Formula: C27H27N5O3 MolecularWeight: 469.53498

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC(=O)C2=CC3=C(C=C2)N=CN=C3NC4=CC=C(C=C4)N5CCOCC5

Isomeric SMILES

COC1=CC=CC(=C1)CNC(=O)C2=CC3=C(C=C2)N=CN=C3NC4=CC=C(C=C4)N5CCOCC5

InChI

InChI=1S/C27H27N5O3/c1-34-23-4-2-3-19(15-23)17-28-27(33)20-5-10-25-24(16-20)26(30-18-29-25)31-21-6-8-22(9-7-21)32-11-13-35-14-12-32/h2-10,15-16,18H,11-14,17H2,1H3,(H,28,33)(H,29,30,31)