N-(1,3-benzodioxol-5-yl)-2-(4-methylphenyl)quinazolin-4-amine

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-(4-methylphenyl)quinazolin-4-amine Openeye Name: N-(1,3-benzodioxol-5-yl)-2-(p-tolyl)quinazolin-4-amine CAS Name: N-(1,3-benzodioxol-5-yl)-2-(4-methylphenyl)-4-quinazolinamine IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-(4-methylphenyl)quinazolin-4-amine Traditional Name: 1,3-benzodioxol-5-yl-[2-(p-tolyl)quinazolin-4-yl]amine Formula: C22H17N3O2 MolecularWeight: 355.38928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H17N3O2/c1-14-6-8-15(9-7-14)21-24-18-5-3-2-4-17(18)22(25-21)23-16-10-11-19-20(12-16)27-13-26-19/h2-12H,13H2,1H3,(H,23,24,25)