2-[4-[4-(3,5-dimethoxyphenyl)carbonylpiperazin-1-yl]-4-oxidanylidene-butyl]-1H-quinazolin-4-one

Systemtic Name: 2-[4-[4-(3,5-dimethoxyphenyl)carbonylpiperazin-1-yl]-4-oxidanylidene-butyl]-1H-quinazolin-4-one Openeye Name: 2-[4-[4-(3,5-dimethoxybenzoyl)piperazin-1-yl]-4-oxo-butyl]-1H-quinazolin-4-one CAS Name: 2-[4-[4-[(3,5-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]-4-oxobutyl]-1H-quinazolin-4-one IUPAC Name: 2-[4-[4-(3,5-dimethoxybenzoyl)piperazin-1-yl]-4-oxobutyl]-1H-quinazolin-4-one Traditional Name: 2-[4-[4-(3,5-dimethoxybenzoyl)piperazino]-4-keto-butyl]-1H-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)CCCC3=NC(=O)C4=CC=CC=C4N3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)N2CCN(CC2)C(=O)CCCC3=NC(=O)C4=CC=CC=C4N3)OC

InChI

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