3-[(2S)-1-[4-(3-chlorophenyl)piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]quinazolin-4-one

Systemtic Name: 3-[(2S)-1-[4-(3-chlorophenyl)piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]quinazolin-4-one Openeye Name: 3-[(1S)-1-[4-(3-chlorophenyl)piperazine-1-carbonyl]-2-methyl-propyl]quinazolin-4-one CAS Name: 3-[(2S)-1-[4-(3-chlorophenyl)-1-piperazinyl]-3-methyl-1-oxobutan-2-yl]-4-quinazolinone IUPAC Name: 3-[(2S)-1-[4-(3-chlorophenyl)piperazin-1-yl]-3-methyl-1-oxobutan-2-yl]quinazolin-4-one Traditional Name: 3-[(1S)-1-[4-(3-chlorophenyl)piperazine-1-carbonyl]-2-methyl-propyl]quinazolin-4-one Formula: C23H25ClN4O2 MolecularWeight: 424.9232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)C2=CC(=CC=C2)Cl)N3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCN(CC1)C2=CC(=CC=C2)Cl)N3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C23H25ClN4O2/c1-16(2)21(28-15-25-20-9-4-3-8-19(20)22(28)29)23(30)27-12-10-26(11-13-27)18-7-5-6-17(24)14-18/h3-9,14-16,21H,10-13H2,1-2H3/t21-/m0/s1