2-(4-tert-butylphenyl)sulfanyl-N-[3-chloranyl-2-(4-methylpiperazin-1-yl)phenyl]ethanamide

Systemtic Name: 2-(4-tert-butylphenyl)sulfanyl-N-[3-chloranyl-2-(4-methylpiperazin-1-yl)phenyl]ethanamide Openeye Name: 2-(4-tert-butylphenyl)sulfanyl-N-[3-chloro-2-(4-methylpiperazin-1-yl)phenyl]acetamide CAS Name: 2-[(4-tert-butylphenyl)thio]-N-[3-chloro-2-(4-methyl-1-piperazinyl)phenyl]acetamide IUPAC Name: 2-(4-tert-butylphenyl)sulfanyl-N-[3-chloro-2-(4-methylpiperazin-1-yl)phenyl]acetamide Traditional Name: 2-[(4-tert-butylphenyl)thio]-N-[3-chloro-2-(4-methylpiperazino)phenyl]acetamide Formula: C23H30ClN3OS MolecularWeight: 432.0218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SCC(=O)NC2=C(C(=CC=C2)Cl)N3CCN(CC3)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SCC(=O)NC2=C(C(=CC=C2)Cl)N3CCN(CC3)C

InChI

InChI=1S/C23H30ClN3OS/c1-23(2,3)17-8-10-18(11-9-17)29-16-21(28)25-20-7-5-6-19(24)22(20)27-14-12-26(4)13-15-27/h5-11H,12-16H2,1-4H3,(H,25,28)