3-(2,4-dimethylphenyl)-2-[(1S)-1-[(3R)-3-methylpiperazin-1-yl]ethyl]quinazolin-4-one

Systemtic Name: 3-(2,4-dimethylphenyl)-2-[(1S)-1-[(3R)-3-methylpiperazin-1-yl]ethyl]quinazolin-4-one Openeye Name: 3-(2,4-dimethylphenyl)-2-[(1S)-1-[(3R)-3-methylpiperazin-1-yl]ethyl]quinazolin-4-one CAS Name: 3-(2,4-dimethylphenyl)-2-[(1S)-1-[(3R)-3-methyl-1-piperazinyl]ethyl]-4-quinazolinone IUPAC Name: 3-(2,4-dimethylphenyl)-2-[(1S)-1-[(3R)-3-methylpiperazin-1-yl]ethyl]quinazolin-4-one Traditional Name: 3-(2,4-dimethylphenyl)-2-[(1S)-1-[(3R)-3-methylpiperazino]ethyl]quinazolin-4-one Formula: C23H28N4O MolecularWeight: 376.49462

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)C(C)C2=NC3=CC=CC=C3C(=O)N2C4=C(C=C(C=C4)C)C

Isomeric SMILES

C[C@@H]1CN(CCN1)[C@@H](C)C2=NC3=CC=CC=C3C(=O)N2C4=C(C=C(C=C4)C)C

InChI

InChI=1S/C23H28N4O/c1-15-9-10-21(16(2)13-15)27-22(18(4)26-12-11-24-17(3)14-26)25-20-8-6-5-7-19(20)23(27)28/h5-10,13,17-18,24H,11-12,14H2,1-4H3/t17-,18+/m1/s1