2-(1,3-benzodioxol-5-yl)-N-[(2,4-dimethoxyphenyl)methyl]quinazolin-4-amine

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-[(2,4-dimethoxyphenyl)methyl]quinazolin-4-amine Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-[(2,4-dimethoxyphenyl)methyl]quinazolin-4-amine CAS Name: 2-(1,3-benzodioxol-5-yl)-N-[(2,4-dimethoxyphenyl)methyl]-4-quinazolinamine IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-[(2,4-dimethoxyphenyl)methyl]quinazolin-4-amine Traditional Name: [2-(1,3-benzodioxol-5-yl)quinazolin-4-yl]-(2,4-dimethoxybenzyl)amine Formula: C24H21N3O4 MolecularWeight: 415.44124

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CNC2=NC(=NC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CNC2=NC(=NC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5)OC

InChI

InChI=1S/C24H21N3O4/c1-28-17-9-7-16(21(12-17)29-2)13-25-24-18-5-3-4-6-19(18)26-23(27-24)15-8-10-20-22(11-15)31-14-30-20/h3-12H,13-14H2,1-2H3,(H,25,26,27)