6-chloranyl-3-ethyl-2-[1-[4-(4-pentylphenyl)carbonylpiperazin-1-yl]ethyl]quinazolin-4-one

Systemtic Name: 6-chloranyl-3-ethyl-2-[1-[4-(4-pentylphenyl)carbonylpiperazin-1-yl]ethyl]quinazolin-4-one Openeye Name: 6-chloro-3-ethyl-2-[1-[4-(4-pentylbenzoyl)piperazin-1-yl]ethyl]quinazolin-4-one CAS Name: 6-chloro-3-ethyl-2-[1-[4-[oxo-(4-pentylphenyl)methyl]-1-piperazinyl]ethyl]-4-quinazolinone IUPAC Name: 6-chloro-3-ethyl-2-[1-[4-(4-pentylbenzoyl)piperazin-1-yl]ethyl]quinazolin-4-one Traditional Name: 2-[1-[4-(4-amylbenzoyl)piperazino]ethyl]-6-chloro-3-ethyl-quinazolin-4-one Formula: C28H35ClN4O2 MolecularWeight: 495.0561

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(C)C3=NC4=C(C=C(C=C4)Cl)C(=O)N3CC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(C)C3=NC4=C(C=C(C=C4)Cl)C(=O)N3CC

InChI

InChI=1S/C28H35ClN4O2/c1-4-6-7-8-21-9-11-22(12-10-21)27(34)32-17-15-31(16-18-32)20(3)26-30-25-14-13-23(29)19-24(25)28(35)33(26)5-2/h9-14,19-20H,4-8,15-18H2,1-3H3