2,2-dimethyl-N-[2-[[3-(4-methylpiperazin-1-yl)carbonylphenyl]methylsulfanyl]phenyl]propanamide

Systemtic Name: 2,2-dimethyl-N-[2-[[3-(4-methylpiperazin-1-yl)carbonylphenyl]methylsulfanyl]phenyl]propanamide Openeye Name: 2,2-dimethyl-N-[2-[[3-(4-methylpiperazine-1-carbonyl)phenyl]methylsulfanyl]phenyl]propanamide CAS Name: 2,2-dimethyl-N-[2-[[3-[(4-methyl-1-piperazinyl)-oxomethyl]phenyl]methylthio]phenyl]propanamide IUPAC Name: 2,2-dimethyl-N-[2-[[3-(4-methylpiperazine-1-carbonyl)phenyl]methylsulfanyl]phenyl]propanamide Traditional Name: 2,2-dimethyl-N-[2-[[3-(4-methylpiperazine-1-carbonyl)benzyl]thio]phenyl]propionamide Formula: C24H31N3O2S MolecularWeight: 425.58684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC=CC=C1SCC2=CC=CC(=C2)C(=O)N3CCN(CC3)C

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC=CC=C1SCC2=CC=CC(=C2)C(=O)N3CCN(CC3)C

InChI

InChI=1S/C24H31N3O2S/c1-24(2,3)23(29)25-20-10-5-6-11-21(20)30-17-18-8-7-9-19(16-18)22(28)27-14-12-26(4)13-15-27/h5-11,16H,12-15,17H2,1-4H3,(H,25,29)