2-[1-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]ethyl]-3-(2-ethoxyphenyl)quinazolin-4-one

Systemtic Name: 2-[1-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]ethyl]-3-(2-ethoxyphenyl)quinazolin-4-one Openeye Name: 2-[1-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]ethyl]-3-(2-ethoxyphenyl)quinazolin-4-one CAS Name: 2-[1-[4-(3,3-dimethyl-1-oxobutyl)-1-piperazinyl]ethyl]-3-(2-ethoxyphenyl)-4-quinazolinone IUPAC Name: 2-[1-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]ethyl]-3-(2-ethoxyphenyl)quinazolin-4-one Traditional Name: 2-[1-[4-(3,3-dimethylbutanoyl)piperazino]ethyl]-3-o-phenetyl-quinazolin-4-one Formula: C28H36N4O3 MolecularWeight: 476.61044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2C(C)N4CCN(CC4)C(=O)CC(C)(C)C

Isomeric SMILES

CCOC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2C(C)N4CCN(CC4)C(=O)CC(C)(C)C

InChI

InChI=1S/C28H36N4O3/c1-6-35-24-14-10-9-13-23(24)32-26(29-22-12-8-7-11-21(22)27(32)34)20(2)30-15-17-31(18-16-30)25(33)19-28(3,4)5/h7-14,20H,6,15-19H2,1-5H3