6-(1,3-benzodioxol-5-yl)-N-[(2,4-dimethoxyphenyl)methyl]quinazolin-4-amine

Systemtic Name: 6-(1,3-benzodioxol-5-yl)-N-[(2,4-dimethoxyphenyl)methyl]quinazolin-4-amine Openeye Name: 6-(1,3-benzodioxol-5-yl)-N-[(2,4-dimethoxyphenyl)methyl]quinazolin-4-amine CAS Name: 6-(1,3-benzodioxol-5-yl)-N-[(2,4-dimethoxyphenyl)methyl]-4-quinazolinamine IUPAC Name: 6-(1,3-benzodioxol-5-yl)-N-[(2,4-dimethoxyphenyl)methyl]quinazolin-4-amine Traditional Name: [6-(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=C2C=C(C=C3)C4=CC5=C(C=C4)OCO5)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CNC2=NC=NC3=C2C=C(C=C3)C4=CC5=C(C=C4)OCO5)OC

InChI

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