7-chloranyl-2-[[4-(2-phenoxyethyl)piperazin-1-yl]methyl]-1H-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[[4-(2-phenoxyethyl)piperazin-1-yl]methyl]-1H-quinazolin-4-one Openeye Name: 7-chloro-2-[[4-(2-phenoxyethyl)piperazin-1-yl]methyl]-1H-quinazolin-4-one CAS Name: 7-chloro-2-[[4-(2-phenoxyethyl)-1-piperazinyl]methyl]-1H-quinazolin-4-one IUPAC Name: 7-chloro-2-[[4-(2-phenoxyethyl)piperazin-1-yl]methyl]-1H-quinazolin-4-one Traditional Name: 7-chloro-2-[[4-(2-phenoxyethyl)piperazino]methyl]-1H-quinazolin-4-one Formula: C21H23ClN4O2 MolecularWeight: 398.88592

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC2=CC=CC=C2)CC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1CCOC2=CC=CC=C2)CC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

InChI

InChI=1S/C21H23ClN4O2/c22-16-6-7-18-19(14-16)23-20(24-21(18)27)15-26-10-8-25(9-11-26)12-13-28-17-4-2-1-3-5-17/h1-7,14H,8-13,15H2,(H,23,24,27)