6-[3-(4,4-dimethoxypiperidin-1-yl)prop-1-ynyl]-N-(3-methyl-4-phenoxy-phenyl)quinazolin-4-amine

Systemtic Name: 6-[3-(4,4-dimethoxypiperidin-1-yl)prop-1-ynyl]-N-(3-methyl-4-phenoxy-phenyl)quinazolin-4-amine Openeye Name: 6-[3-(4,4-dimethoxy-1-piperidyl)prop-1-ynyl]-N-(3-methyl-4-phenoxy-phenyl)quinazolin-4-amine CAS Name: 6-[3-(4,4-dimethoxy-1-piperidinyl)prop-1-ynyl]-N-(3-methyl-4-phenoxyphenyl)-4-quinazolinamine IUPAC Name: 6-[3-(4,4-dimethoxypiperidin-1-yl)prop-1-ynyl]-N-(3-methyl-4-phenoxyphenyl)quinazolin-4-amine Traditional Name: [6-[3-(4,4-dimethoxypiperidino)prop-1-ynyl]quinazolin-4-yl]-(3-methyl-4-phenoxy-phenyl)amine Formula: C31H32N4O3 MolecularWeight: 508.61078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)C#CCN4CCC(CC4)(OC)OC)OC5=CC=CC=C5

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)C#CCN4CCC(CC4)(OC)OC)OC5=CC=CC=C5

InChI

InChI=1S/C31H32N4O3/c1-23-20-25(12-14-29(23)38-26-9-5-4-6-10-26)34-30-27-21-24(11-13-28(27)32-22-33-30)8-7-17-35-18-15-31(36-2,37-3)16-19-35/h4-6,9-14,20-22H,15-19H2,1-3H3,(H,32,33,34)