2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]-6,7-dimethoxy-N-(phenylmethyl)quinazolin-4-amine

Systemtic Name: 2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]-6,7-dimethoxy-N-(phenylmethyl)quinazolin-4-amine Openeye Name: N-benzyl-2-[(E)-2-(3,5-dimethoxyphenyl)vinyl]-6,7-dimethoxy-quinazolin-4-amine CAS Name: 2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]-6,7-dimethoxy-N-(phenylmethyl)-4-quinazolinamine IUPAC Name: N-benzyl-2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]-6,7-dimethoxyquinazolin-4-amine Traditional Name: benzyl-[2-[(E)-2-(3,5-dimethoxyphenyl)vinyl]-6,7-dimethoxy-quinazolin-4-yl]amine Formula: C27H27N3O4 MolecularWeight: 457.52098

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C=CC2=NC3=CC(=C(C=C3C(=N2)NCC4=CC=CC=C4)OC)OC)OC

Isomeric SMILES

COC1=CC(=CC(=C1)/C=C/C2=NC3=CC(=C(C=C3C(=N2)NCC4=CC=CC=C4)OC)OC)OC

InChI

InChI=1S/C27H27N3O4/c1-31-20-12-19(13-21(14-20)32-2)10-11-26-29-23-16-25(34-4)24(33-3)15-22(23)27(30-26)28-17-18-8-6-5-7-9-18/h5-16H,17H2,1-4H3,(H,28,29,30)/b11-10+