N-[5-chloranyl-2-(4-methylpiperazin-1-yl)phenyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[5-chloranyl-2-(4-methylpiperazin-1-yl)phenyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-[5-chloro-2-(4-methylpiperazin-1-yl)phenyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-[5-chloro-2-(4-methyl-1-piperazinyl)phenyl]-2-[(4,6-dimethyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-[5-chloro-2-(4-methylpiperazin-1-yl)phenyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-[5-chloro-2-(4-methylpiperazino)phenyl]-2-[(4,6-dimethylpyrimidin-2-yl)thio]acetamide Formula: C19H24ClN5OS MolecularWeight: 405.94476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC2=C(C=CC(=C2)Cl)N3CCN(CC3)C)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC2=C(C=CC(=C2)Cl)N3CCN(CC3)C)C

InChI

InChI=1S/C19H24ClN5OS/c1-13-10-14(2)22-19(21-13)27-12-18(26)23-16-11-15(20)4-5-17(16)25-8-6-24(3)7-9-25/h4-5,10-11H,6-9,12H2,1-3H3,(H,23,26)