1-[4-[2-(4-methoxyphenyl)quinazolin-4-yl]piperazin-1-yl]-3,3-dimethyl-butan-1-one

Systemtic Name: 1-[4-[2-(4-methoxyphenyl)quinazolin-4-yl]piperazin-1-yl]-3,3-dimethyl-butan-1-one Openeye Name: 1-[4-[2-(4-methoxyphenyl)quinazolin-4-yl]piperazin-1-yl]-3,3-dimethyl-butan-1-one CAS Name: 1-[4-[2-(4-methoxyphenyl)-4-quinazolinyl]-1-piperazinyl]-3,3-dimethyl-1-butanone IUPAC Name: 1-[4-[2-(4-methoxyphenyl)quinazolin-4-yl]piperazin-1-yl]-3,3-dimethylbutan-1-one Traditional Name: 1-[4-[2-(4-methoxyphenyl)quinazolin-4-yl]piperazino]-3,3-dimethyl-butan-1-one Formula: C25H30N4O2 MolecularWeight: 418.5313

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)N1CCN(CC1)C2=NC(=NC3=CC=CC=C32)C4=CC=C(C=C4)OC

Isomeric SMILES

CC(C)(C)CC(=O)N1CCN(CC1)C2=NC(=NC3=CC=CC=C32)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H30N4O2/c1-25(2,3)17-22(30)28-13-15-29(16-14-28)24-20-7-5-6-8-21(20)26-23(27-24)18-9-11-19(31-4)12-10-18/h5-12H,13-17H2,1-4H3