2-[[4-[3-(4-ethylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[4-[3-(4-ethylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[4-[3-(4-ethylphenoxy)-2-hydroxy-propyl]piperazin-1-yl]methyl]-1H-quinazolin-4-one CAS Name: 2-[[4-[3-(4-ethylphenoxy)-2-hydroxypropyl]-1-piperazinyl]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[4-[3-(4-ethylphenoxy)-2-hydroxypropyl]piperazin-1-yl]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[4-[3-(4-ethylphenoxy)-2-hydroxy-propyl]piperazino]methyl]-1H-quinazolin-4-one Formula: C24H30N4O3 MolecularWeight: 422.52

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC(CN2CCN(CC2)CC3=NC(=O)C4=CC=CC=C4N3)O

Isomeric SMILES

CCC1=CC=C(C=C1)OCC(CN2CCN(CC2)CC3=NC(=O)C4=CC=CC=C4N3)O

InChI

InChI=1S/C24H30N4O3/c1-2-18-7-9-20(10-8-18)31-17-19(29)15-27-11-13-28(14-12-27)16-23-25-22-6-4-3-5-21(22)24(30)26-23/h3-10,19,29H,2,11-17H2,1H3,(H,25,26,30)