1-[(4-azanylquinazolin-7-yl)methyl]-4-[2-(3-chloranylphenoxy)ethanoyl]-6-methyl-3-propyl-piperazin-2-one

Systemtic Name: 1-[(4-azanylquinazolin-7-yl)methyl]-4-[2-(3-chloranylphenoxy)ethanoyl]-6-methyl-3-propyl-piperazin-2-one Openeye Name: 1-[(4-aminoquinazolin-7-yl)methyl]-4-[2-(3-chlorophenoxy)acetyl]-6-methyl-3-propyl-piperazin-2-one CAS Name: 1-[(4-amino-7-quinazolinyl)methyl]-4-[2-(3-chlorophenoxy)-1-oxoethyl]-6-methyl-3-propyl-2-piperazinone IUPAC Name: 1-[(4-aminoquinazolin-7-yl)methyl]-4-[2-(3-chlorophenoxy)acetyl]-6-methyl-3-propylpiperazin-2-one Traditional Name: 1-[(4-aminoquinazolin-7-yl)methyl]-4-[2-(3-chlorophenoxy)acetyl]-6-methyl-3-propyl-piperazin-2-one Formula: C25H28ClN5O3 MolecularWeight: 481.97452

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(=O)N(C(CN1C(=O)COC2=CC(=CC=C2)Cl)C)CC3=CC4=C(C=C3)C(=NC=N4)N

Isomeric SMILES

CCCC1C(=O)N(C(CN1C(=O)COC2=CC(=CC=C2)Cl)C)CC3=CC4=C(C=C3)C(=NC=N4)N

InChI

InChI=1S/C25H28ClN5O3/c1-3-5-22-25(33)30(13-17-8-9-20-21(10-17)28-15-29-24(20)27)16(2)12-31(22)23(32)14-34-19-7-4-6-18(26)11-19/h4,6-11,15-16,22H,3,5,12-14H2,1-2H3,(H2,27,28,29)