1-[4-[2-[[phenethyl-(phenylmethyl)amino]methyl]quinazolin-4-yl]piperazin-1-yl]ethanone

Systemtic Name: 1-[4-[2-[[phenethyl-(phenylmethyl)amino]methyl]quinazolin-4-yl]piperazin-1-yl]ethanone Openeye Name: 1-[4-[2-[[benzyl(phenethyl)amino]methyl]quinazolin-4-yl]piperazin-1-yl]ethanone CAS Name: 1-[4-[2-[[phenethyl-(phenylmethyl)amino]methyl]-4-quinazolinyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[2-[[benzyl(phenethyl)amino]methyl]quinazolin-4-yl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[2-[[benzyl(phenethyl)amino]methyl]quinazolin-4-yl]piperazino]ethanone Formula: C30H33N5O MolecularWeight: 479.61592

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=NC(=NC3=CC=CC=C32)CN(CCC4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=NC(=NC3=CC=CC=C32)CN(CCC4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C30H33N5O/c1-24(36)34-18-20-35(21-19-34)30-27-14-8-9-15-28(27)31-29(32-30)23-33(22-26-12-6-3-7-13-26)17-16-25-10-4-2-5-11-25/h2-15H,16-23H2,1H3