6-chloranyl-2-[1-[4-(2-ethylhexanoyl)piperazin-1-yl]ethyl]-3-methyl-quinazolin-4-one

Systemtic Name: 6-chloranyl-2-[1-[4-(2-ethylhexanoyl)piperazin-1-yl]ethyl]-3-methyl-quinazolin-4-one Openeye Name: 6-chloro-2-[1-[4-(2-ethylhexanoyl)piperazin-1-yl]ethyl]-3-methyl-quinazolin-4-one CAS Name: 6-chloro-2-[1-[4-(2-ethyl-1-oxohexyl)-1-piperazinyl]ethyl]-3-methyl-4-quinazolinone IUPAC Name: 6-chloro-2-[1-[4-(2-ethylhexanoyl)piperazin-1-yl]ethyl]-3-methylquinazolin-4-one Traditional Name: 6-chloro-2-[1-[4-(2-ethylhexanoyl)piperazino]ethyl]-3-methyl-quinazolin-4-one Formula: C23H33ClN4O2 MolecularWeight: 432.98672

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)N1CCN(CC1)C(C)C2=NC3=C(C=C(C=C3)Cl)C(=O)N2C

Isomeric SMILES

CCCCC(CC)C(=O)N1CCN(CC1)C(C)C2=NC3=C(C=C(C=C3)Cl)C(=O)N2C

InChI

InChI=1S/C23H33ClN4O2/c1-5-7-8-17(6-2)22(29)28-13-11-27(12-14-28)16(3)21-25-20-10-9-18(24)15-19(20)23(30)26(21)4/h9-10,15-17H,5-8,11-14H2,1-4H3