2-(4-methoxyphenyl)-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]quinazolin-4-amine

Systemtic Name: 2-(4-methoxyphenyl)-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]quinazolin-4-amine Openeye Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-2-(4-methoxyphenyl)quinazolin-4-amine CAS Name: 2-(4-methoxyphenyl)-N-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]-4-quinazolinamine IUPAC Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-2-(4-methoxyphenyl)quinazolin-4-amine Traditional Name: 3-(4-benzylpiperazino)propyl-[2-(4-methoxyphenyl)quinazolin-4-yl]amine Formula: C29H33N5O MolecularWeight: 467.60522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)NCCCN4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)NCCCN4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C29H33N5O/c1-35-25-14-12-24(13-15-25)28-31-27-11-6-5-10-26(27)29(32-28)30-16-7-17-33-18-20-34(21-19-33)22-23-8-3-2-4-9-23/h2-6,8-15H,7,16-22H2,1H3,(H,30,31,32)