3-(4-ethoxyphenyl)-2-[1-(3-methyl-4-tetradecanoyl-piperazin-1-yl)ethyl]quinazolin-4-one

Systemtic Name: 3-(4-ethoxyphenyl)-2-[1-(3-methyl-4-tetradecanoyl-piperazin-1-yl)ethyl]quinazolin-4-one Openeye Name: 3-(4-ethoxyphenyl)-2-[1-(3-methyl-4-tetradecanoyl-piperazin-1-yl)ethyl]quinazolin-4-one CAS Name: 3-(4-ethoxyphenyl)-2-[1-[3-methyl-4-(1-oxotetradecyl)-1-piperazinyl]ethyl]-4-quinazolinone IUPAC Name: 3-(4-ethoxyphenyl)-2-[1-(3-methyl-4-tetradecanoylpiperazin-1-yl)ethyl]quinazolin-4-one Traditional Name: 2-[1-(3-methyl-4-tetradecanoyl-piperazino)ethyl]-3-p-phenetyl-quinazolin-4-one Formula: C37H54N4O3 MolecularWeight: 602.84966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C37H54N4O3/c1-5-7-8-9-10-11-12-13-14-15-16-21-35(42)40-27-26-39(28-29(40)3)30(4)36-38-34-20-18-17-19-33(34)37(43)41(36)31-22-24-32(25-23-31)44-6-2/h17-20,22-25,29-30H,5-16,21,26-28H2,1-4H3