3-[3-[4-[2-(4-fluorophenyl)cyclopropyl]carbonylpiperazin-1-yl]-3-oxidanylidene-propyl]quinazolin-4-one

Systemtic Name: 3-[3-[4-[2-(4-fluorophenyl)cyclopropyl]carbonylpiperazin-1-yl]-3-oxidanylidene-propyl]quinazolin-4-one Openeye Name: 3-[3-[4-[2-(4-fluorophenyl)cyclopropanecarbonyl]piperazin-1-yl]-3-oxo-propyl]quinazolin-4-one CAS Name: 3-[3-[4-[[2-(4-fluorophenyl)cyclopropyl]-oxomethyl]-1-piperazinyl]-3-oxopropyl]-4-quinazolinone IUPAC Name: 3-[3-[4-[2-(4-fluorophenyl)cyclopropanecarbonyl]piperazin-1-yl]-3-oxopropyl]quinazolin-4-one Traditional Name: 3-[3-[4-[2-(4-fluorophenyl)cyclopropanecarbonyl]piperazino]-3-keto-propyl]quinazolin-4-one Formula: C25H25FN4O3 MolecularWeight: 448.489403

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCN2C=NC3=CC=CC=C3C2=O)C(=O)C4CC4C5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCN1C(=O)CCN2C=NC3=CC=CC=C3C2=O)C(=O)C4CC4C5=CC=C(C=C5)F

InChI

InChI=1S/C25H25FN4O3/c26-18-7-5-17(6-8-18)20-15-21(20)25(33)29-13-11-28(12-14-29)23(31)9-10-30-16-27-22-4-2-1-3-19(22)24(30)32/h1-8,16,20-21H,9-15H2