2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[2-(4-phenylpiperazin-1-yl)ethyl]ethanamide

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[2-(4-phenylpiperazin-1-yl)ethyl]ethanamide Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[2-(4-phenylpiperazin-1-yl)ethyl]acetamide CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-[2-(4-phenyl-1-piperazinyl)ethyl]acetamide IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[2-(4-phenylpiperazin-1-yl)ethyl]acetamide Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-N-[2-(4-phenylpiperazino)ethyl]acetamide Formula: C20H27N5OS MolecularWeight: 385.52628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NCCN2CCN(CC2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NCCN2CCN(CC2)C3=CC=CC=C3)C

InChI

InChI=1S/C20H27N5OS/c1-16-14-17(2)23-20(22-16)27-15-19(26)21-8-9-24-10-12-25(13-11-24)18-6-4-3-5-7-18/h3-7,14H,8-13,15H2,1-2H3,(H,21,26)