2-[1-(4-decanoyl-3-methyl-piperazin-1-yl)ethyl]-3-(4-methylphenyl)quinazolin-4-one

Systemtic Name: 2-[1-(4-decanoyl-3-methyl-piperazin-1-yl)ethyl]-3-(4-methylphenyl)quinazolin-4-one Openeye Name: 2-[1-(4-decanoyl-3-methyl-piperazin-1-yl)ethyl]-3-(p-tolyl)quinazolin-4-one CAS Name: 2-[1-[3-methyl-4-(1-oxodecyl)-1-piperazinyl]ethyl]-3-(4-methylphenyl)-4-quinazolinone IUPAC Name: 2-[1-(4-decanoyl-3-methylpiperazin-1-yl)ethyl]-3-(4-methylphenyl)quinazolin-4-one Traditional Name: 2-[1-(4-capryl-3-methyl-piperazino)ethyl]-3-(p-tolyl)quinazolin-4-one Formula: C32H44N4O2 MolecularWeight: 516.71736

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H44N4O2/c1-5-6-7-8-9-10-11-16-30(37)35-22-21-34(23-25(35)3)26(4)31-33-29-15-13-12-14-28(29)32(38)36(31)27-19-17-24(2)18-20-27/h12-15,17-20,25-26H,5-11,16,21-23H2,1-4H3