1-[[2,3-bis(fluoranyl)phenyl]methyl]-5-piperazin-1-yl-3-propan-2-yl-4H-quinazolin-2-one hydrochloride

Systemtic Name: 1-[[2,3-bis(fluoranyl)phenyl]methyl]-5-piperazin-1-yl-3-propan-2-yl-4H-quinazolin-2-one hydrochloride Openeye Name: 1-[(2,3-difluorophenyl)methyl]-3-isopropyl-5-piperazin-1-yl-4H-quinazolin-2-one hydrochloride CAS Name: 1-[(2,3-difluorophenyl)methyl]-5-(1-piperazinyl)-3-propan-2-yl-4H-quinazolin-2-one hydrochloride IUPAC Name: 1-[(2,3-difluorophenyl)methyl]-5-piperazin-1-yl-3-propan-2-yl-4H-quinazolin-2-one hydrochloride Traditional Name: 1-(2,3-difluorobenzyl)-3-isopropyl-5-piperazino-4H-quinazolin-2-one hydrochloride Formula: C22H27ClF2N4O MolecularWeight: 436.925786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CC2=C(C=CC=C2N3CCNCC3)N(C1=O)CC4=C(C(=CC=C4)F)F.Cl

Isomeric SMILES

CC(C)N1CC2=C(C=CC=C2N3CCNCC3)N(C1=O)CC4=C(C(=CC=C4)F)F.Cl

InChI

InChI=1S/C22H26F2N4O.ClH/c1-15(2)27-14-17-19(26-11-9-25-10-12-26)7-4-8-20(17)28(22(27)29)13-16-5-3-6-18(23)21(16)24;/h3-8,15,25H,9-14H2,1-2H3;1H