3-[(2S)-1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl]quinazolin-4-one

Systemtic Name: 3-[(2S)-1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl]quinazolin-4-one Openeye Name: 3-[(1S)-1-methyl-2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]quinazolin-4-one CAS Name: 3-[(2S)-1-oxo-1-(4-phenyl-1-piperazinyl)propan-2-yl]-4-quinazolinone IUPAC Name: 3-[(2S)-1-oxo-1-(4-phenylpiperazin-1-yl)propan-2-yl]quinazolin-4-one Traditional Name: 3-[(1S)-2-keto-1-methyl-2-(4-phenylpiperazino)ethyl]quinazolin-4-one Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N4O2/c1-16(25-15-22-19-10-6-5-9-18(19)21(25)27)20(26)24-13-11-23(12-14-24)17-7-3-2-4-8-17/h2-10,15-16H,11-14H2,1H3/t16-/m0/s1