N2-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-N4-phenethyl-quinazoline-2,4-diamine

Systemtic Name: N2-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-N4-phenethyl-quinazoline-2,4-diamine Openeye Name: N2-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-N4-phenethyl-quinazoline-2,4-diamine CAS Name: N2-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-N4-phenethylquinazoline-2,4-diamine IUPAC Name: 2-N-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-4-N-phenethylquinazoline-2,4-diamine Traditional Name: [6,7-dimethoxy-4-(phenethylamino)quinazolin-2-yl]-veratryl-amine Formula: C27H30N4O4 MolecularWeight: 474.5515

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=NC3=CC(=C(C=C3C(=N2)NCCC4=CC=CC=C4)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=NC3=CC(=C(C=C3C(=N2)NCCC4=CC=CC=C4)OC)OC)OC

InChI

InChI=1S/C27H30N4O4/c1-32-22-11-10-19(14-23(22)33-2)17-29-27-30-21-16-25(35-4)24(34-3)15-20(21)26(31-27)28-13-12-18-8-6-5-7-9-18/h5-11,14-16H,12-13,17H2,1-4H3,(H2,28,29,30,31)