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

Systemtic Name: 3-[3-oxidanylidene-3-[4-(2-phenylcyclopropyl)carbonylpiperazin-1-yl]propyl]quinazolin-4-one Openeye Name: 3-[3-oxo-3-[4-(2-phenylcyclopropanecarbonyl)piperazin-1-yl]propyl]quinazolin-4-one CAS Name: 3-[3-oxo-3-[4-[oxo-(2-phenylcyclopropyl)methyl]-1-piperazinyl]propyl]-4-quinazolinone IUPAC Name: 3-[3-oxo-3-[4-(2-phenylcyclopropanecarbonyl)piperazin-1-yl]propyl]quinazolin-4-one Traditional Name: 3-[3-keto-3-[4-(2-phenylcyclopropanecarbonyl)piperazino]propyl]quinazolin-4-one Formula: C25H26N4O3 MolecularWeight: 430.49894

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H26N4O3/c30-23(10-11-29-17-26-22-9-5-4-8-19(22)24(29)31)27-12-14-28(15-13-27)25(32)21-16-20(21)18-6-2-1-3-7-18/h1-9,17,20-21H,10-16H2