1-[4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-yl]-2-(4-chloranyl-3-methyl-phenoxy)ethanone

Systemtic Name: 1-[4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-yl]-2-(4-chloranyl-3-methyl-phenoxy)ethanone Openeye Name: 1-[4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-yl]-2-(4-chloro-3-methyl-phenoxy)ethanone CAS Name: 1-[4-[(4-amino-2-quinazolinyl)methyl]-1-piperazinyl]-2-(4-chloro-3-methylphenoxy)ethanone IUPAC Name: 1-[4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-yl]-2-(4-chloro-3-methylphenoxy)ethanone Traditional Name: 1-[4-[(4-aminoquinazolin-2-yl)methyl]piperazino]-2-(4-chloro-3-methyl-phenoxy)ethanone Formula: C22H24ClN5O2 MolecularWeight: 425.91126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4C(=N3)N)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4C(=N3)N)Cl

InChI

InChI=1S/C22H24ClN5O2/c1-15-12-16(6-7-18(15)23)30-14-21(29)28-10-8-27(9-11-28)13-20-25-19-5-3-2-4-17(19)22(24)26-20/h2-7,12H,8-11,13-14H2,1H3,(H2,24,25,26)