N-[(3,4-dimethoxyphenyl)methyl]-2-[[furan-2-ylmethyl(prop-2-ynyl)amino]methyl]-N-methyl-quinazolin-4-amine

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[[furan-2-ylmethyl(prop-2-ynyl)amino]methyl]-N-methyl-quinazolin-4-amine Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[[2-furylmethyl(prop-2-ynyl)amino]methyl]-N-methyl-quinazolin-4-amine CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[[2-furanylmethyl(prop-2-ynyl)amino]methyl]-N-methyl-4-quinazolinamine IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[[furan-2-ylmethyl(prop-2-ynyl)amino]methyl]-N-methylquinazolin-4-amine Traditional Name: 2-furfuryl-[[4-[methyl(veratryl)amino]quinazolin-2-yl]methyl]-propargyl-amine Formula: C27H28N4O3 MolecularWeight: 456.53622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OC)OC)C2=NC(=NC3=CC=CC=C32)CN(CC#C)CC4=CC=CO4

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OC)OC)C2=NC(=NC3=CC=CC=C32)CN(CC#C)CC4=CC=CO4

InChI

InChI=1S/C27H28N4O3/c1-5-14-31(18-21-9-8-15-34-21)19-26-28-23-11-7-6-10-22(23)27(29-26)30(2)17-20-12-13-24(32-3)25(16-20)33-4/h1,6-13,15-16H,14,17-19H2,2-4H3