4-[(4-azanylquinazolin-7-yl)methyl]-N-(4-chlorophenyl)-3-oxidanylidene-2-propyl-piperazine-1-carboxamide

Systemtic Name: 4-[(4-azanylquinazolin-7-yl)methyl]-N-(4-chlorophenyl)-3-oxidanylidene-2-propyl-piperazine-1-carboxamide Openeye Name: 4-[(4-aminoquinazolin-7-yl)methyl]-N-(4-chlorophenyl)-3-oxo-2-propyl-piperazine-1-carboxamide CAS Name: 4-[(4-amino-7-quinazolinyl)methyl]-N-(4-chlorophenyl)-3-oxo-2-propyl-1-piperazinecarboxamide IUPAC Name: 4-[(4-aminoquinazolin-7-yl)methyl]-N-(4-chlorophenyl)-3-oxo-2-propylpiperazine-1-carboxamide Traditional Name: 4-[(4-aminoquinazolin-7-yl)methyl]-N-(4-chlorophenyl)-3-keto-2-propyl-piperazine-1-carboxamide Formula: C23H25ClN6O2 MolecularWeight: 452.9366

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(=O)N(CCN1C(=O)NC2=CC=C(C=C2)Cl)CC3=CC4=C(C=C3)C(=NC=N4)N

Isomeric SMILES

CCCC1C(=O)N(CCN1C(=O)NC2=CC=C(C=C2)Cl)CC3=CC4=C(C=C3)C(=NC=N4)N

InChI

InChI=1S/C23H25ClN6O2/c1-2-3-20-22(31)29(13-15-4-9-18-19(12-15)26-14-27-21(18)25)10-11-30(20)23(32)28-17-7-5-16(24)6-8-17/h4-9,12,14,20H,2-3,10-11,13H2,1H3,(H,28,32)(H2,25,26,27)