3-(4-bromophenyl)-2-[1-(4-decanoyl-3-methyl-piperazin-1-yl)propyl]quinazolin-4-one

Systemtic Name: 3-(4-bromophenyl)-2-[1-(4-decanoyl-3-methyl-piperazin-1-yl)propyl]quinazolin-4-one Openeye Name: 3-(4-bromophenyl)-2-[1-(4-decanoyl-3-methyl-piperazin-1-yl)propyl]quinazolin-4-one CAS Name: 3-(4-bromophenyl)-2-[1-[3-methyl-4-(1-oxodecyl)-1-piperazinyl]propyl]-4-quinazolinone IUPAC Name: 3-(4-bromophenyl)-2-[1-(4-decanoyl-3-methylpiperazin-1-yl)propyl]quinazolin-4-one Traditional Name: 3-(4-bromophenyl)-2-[1-(4-capryl-3-methyl-piperazino)propyl]quinazolin-4-one Formula: C32H43BrN4O2 MolecularWeight: 595.61342

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)N1CCN(CC1C)C(CC)C2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)Br

Isomeric SMILES

CCCCCCCCCC(=O)N1CCN(CC1C)C(CC)C2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)Br

InChI

InChI=1S/C32H43BrN4O2/c1-4-6-7-8-9-10-11-16-30(38)36-22-21-35(23-24(36)3)29(5-2)31-34-28-15-13-12-14-27(28)32(39)37(31)26-19-17-25(33)18-20-26/h12-15,17-20,24,29H,4-11,16,21-23H2,1-3H3