(2R)-2-(4,8-dimethylquinolin-2-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)propan-1-one

Systemtic Name: (2R)-2-(4,8-dimethylquinolin-2-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)propan-1-one Openeye Name: (2R)-2-[(4,8-dimethyl-2-quinolyl)sulfanyl]-1-(4-phenylpiperazin-1-yl)propan-1-one CAS Name: (2R)-2-[(4,8-dimethyl-2-quinolinyl)thio]-1-(4-phenyl-1-piperazinyl)-1-propanone IUPAC Name: (2R)-2-(4,8-dimethylquinolin-2-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)propan-1-one Traditional Name: (2R)-2-[(4,8-dimethyl-2-quinolyl)thio]-1-(4-phenylpiperazino)propan-1-one Formula: C24H27N3OS MolecularWeight: 405.55568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SC(C)C(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)S[C@H](C)C(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C24H27N3OS/c1-17-8-7-11-21-18(2)16-22(25-23(17)21)29-19(3)24(28)27-14-12-26(13-15-27)20-9-5-4-6-10-20/h4-11,16,19H,12-15H2,1-3H3/t19-/m1/s1