2-[6-(2-chlorophenyl)-2-(propan-2-ylamino)quinazolin-7-yl]oxy-1-(4-methylpiperazin-1-yl)ethanone

Systemtic Name: 2-[6-(2-chlorophenyl)-2-(propan-2-ylamino)quinazolin-7-yl]oxy-1-(4-methylpiperazin-1-yl)ethanone Openeye Name: 2-[6-(2-chlorophenyl)-2-(isopropylamino)quinazolin-7-yl]oxy-1-(4-methylpiperazin-1-yl)ethanone CAS Name: 2-[[6-(2-chlorophenyl)-2-(propan-2-ylamino)-7-quinazolinyl]oxy]-1-(4-methyl-1-piperazinyl)ethanone IUPAC Name: 2-[6-(2-chlorophenyl)-2-(propan-2-ylamino)quinazolin-7-yl]oxy-1-(4-methylpiperazin-1-yl)ethanone Traditional Name: 2-[6-(2-chlorophenyl)-2-(isopropylamino)quinazolin-7-yl]oxy-1-(4-methylpiperazino)ethanone Formula: C24H28ClN5O2 MolecularWeight: 453.96442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NC2=CC(=C(C=C2C=N1)C3=CC=CC=C3Cl)OCC(=O)N4CCN(CC4)C

Isomeric SMILES

CC(C)NC1=NC2=CC(=C(C=C2C=N1)C3=CC=CC=C3Cl)OCC(=O)N4CCN(CC4)C

InChI

InChI=1S/C24H28ClN5O2/c1-16(2)27-24-26-14-17-12-19(18-6-4-5-7-20(18)25)22(13-21(17)28-24)32-15-23(31)30-10-8-29(3)9-11-30/h4-7,12-14,16H,8-11,15H2,1-3H3,(H,26,27,28)