3-(2-methoxyphenyl)-2-[1-(3-methyl-4-pentanoyl-piperazin-1-yl)ethyl]quinazolin-4-one

Systemtic Name: 3-(2-methoxyphenyl)-2-[1-(3-methyl-4-pentanoyl-piperazin-1-yl)ethyl]quinazolin-4-one Openeye Name: 3-(2-methoxyphenyl)-2-[1-(3-methyl-4-pentanoyl-piperazin-1-yl)ethyl]quinazolin-4-one CAS Name: 3-(2-methoxyphenyl)-2-[1-[3-methyl-4-(1-oxopentyl)-1-piperazinyl]ethyl]-4-quinazolinone IUPAC Name: 3-(2-methoxyphenyl)-2-[1-(3-methyl-4-pentanoylpiperazin-1-yl)ethyl]quinazolin-4-one Traditional Name: 3-(2-methoxyphenyl)-2-[1-(3-methyl-4-valeryl-piperazino)ethyl]quinazolin-4-one Formula: C27H34N4O3 MolecularWeight: 462.58386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1CCN(CC1C)C(C)C2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4OC

Isomeric SMILES

CCCCC(=O)N1CCN(CC1C)C(C)C2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4OC

InChI

InChI=1S/C27H34N4O3/c1-5-6-15-25(32)30-17-16-29(18-19(30)2)20(3)26-28-22-12-8-7-11-21(22)27(33)31(26)23-13-9-10-14-24(23)34-4/h7-14,19-20H,5-6,15-18H2,1-4H3