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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)CC(C)C)C(C)C2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4OC

Isomeric SMILES

CC1CN(CCN1C(=O)CC(C)C)C(C)C2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4OC

InChI

InChI=1S/C27H34N4O3/c1-18(2)16-25(32)30-15-14-29(17-19(30)3)20(4)26-28-22-11-7-6-10-21(22)27(33)31(26)23-12-8-9-13-24(23)34-5/h6-13,18-20H,14-17H2,1-5H3