N-[3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl]-2-(4-methoxyphenyl)quinazolin-4-amine

Systemtic Name: N-[3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl]-2-(4-methoxyphenyl)quinazolin-4-amine Openeye Name: N-[3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl]-2-(4-methoxyphenyl)quinazolin-4-amine CAS Name: N-[3-[4-(2,5-dimethylphenyl)-1-piperazinyl]propyl]-2-(4-methoxyphenyl)-4-quinazolinamine IUPAC Name: N-[3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl]-2-(4-methoxyphenyl)quinazolin-4-amine Traditional Name: 3-[4-(2,5-dimethylphenyl)piperazino]propyl-[2-(4-methoxyphenyl)quinazolin-4-yl]amine Formula: C30H35N5O MolecularWeight: 481.6318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)CCCNC3=NC(=NC4=CC=CC=C43)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)CCCNC3=NC(=NC4=CC=CC=C43)C5=CC=C(C=C5)OC

InChI

InChI=1S/C30H35N5O/c1-22-9-10-23(2)28(21-22)35-19-17-34(18-20-35)16-6-15-31-30-26-7-4-5-8-27(26)32-29(33-30)24-11-13-25(36-3)14-12-24/h4-5,7-14,21H,6,15-20H2,1-3H3,(H,31,32,33)