3-[4-[4-(3,5-dimethoxyphenyl)carbonylpiperazin-1-yl]-4-oxidanylidene-butyl]quinazolin-4-one

Systemtic Name: 3-[4-[4-(3,5-dimethoxyphenyl)carbonylpiperazin-1-yl]-4-oxidanylidene-butyl]quinazolin-4-one Openeye Name: 3-[4-[4-(3,5-dimethoxybenzoyl)piperazin-1-yl]-4-oxo-butyl]quinazolin-4-one CAS Name: 3-[4-[4-[(3,5-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]-4-oxobutyl]-4-quinazolinone IUPAC Name: 3-[4-[4-(3,5-dimethoxybenzoyl)piperazin-1-yl]-4-oxobutyl]quinazolin-4-one Traditional Name: 3-[4-[4-(3,5-dimethoxybenzoyl)piperazino]-4-keto-butyl]quinazolin-4-one Formula: C25H28N4O5 MolecularWeight: 464.51362

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)N2CCN(CC2)C(=O)CCCN3C=NC4=CC=CC=C4C3=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)N2CCN(CC2)C(=O)CCCN3C=NC4=CC=CC=C4C3=O)OC

InChI

InChI=1S/C25H28N4O5/c1-33-19-14-18(15-20(16-19)34-2)24(31)28-12-10-27(11-13-28)23(30)8-5-9-29-17-26-22-7-4-3-6-21(22)25(29)32/h3-4,6-7,14-17H,5,8-13H2,1-2H3