N-[(2,5-dimethoxyphenyl)methyl]-4-[(3-methylphenyl)amino]quinazoline-2-carboxamide

Systemtic Name: N-[(2,5-dimethoxyphenyl)methyl]-4-[(3-methylphenyl)amino]quinazoline-2-carboxamide Openeye Name: N-[(2,5-dimethoxyphenyl)methyl]-4-(3-methylanilino)quinazoline-2-carboxamide CAS Name: N-[(2,5-dimethoxyphenyl)methyl]-4-(3-methylanilino)-2-quinazolinecarboxamide IUPAC Name: N-[(2,5-dimethoxyphenyl)methyl]-4-(3-methylanilino)quinazoline-2-carboxamide Traditional Name: N-(2,5-dimethoxybenzyl)-4-(m-toluidino)quinazoline-2-carboxamide Formula: C25H24N4O3 MolecularWeight: 428.48306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC(=NC3=CC=CC=C32)C(=O)NCC4=C(C=CC(=C4)OC)OC

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC(=NC3=CC=CC=C32)C(=O)NCC4=C(C=CC(=C4)OC)OC

InChI

InChI=1S/C25H24N4O3/c1-16-7-6-8-18(13-16)27-23-20-9-4-5-10-21(20)28-24(29-23)25(30)26-15-17-14-19(31-2)11-12-22(17)32-3/h4-14H,15H2,1-3H3,(H,26,30)(H,27,28,29)