2-[4-chloranyl-6-[(3S)-4-ethanoyl-3-methyl-piperazin-1-yl]pyrimidin-2-yl]sulfanyl-N-[(2S)-3-methylbutan-2-yl]ethanamide

Systemtic Name: 2-[4-chloranyl-6-[(3S)-4-ethanoyl-3-methyl-piperazin-1-yl]pyrimidin-2-yl]sulfanyl-N-[(2S)-3-methylbutan-2-yl]ethanamide Openeye Name: 2-[4-[(3S)-4-acetyl-3-methyl-piperazin-1-yl]-6-chloro-pyrimidin-2-yl]sulfanyl-N-[(1S)-1,2-dimethylpropyl]acetamide CAS Name: 2-[[4-[(3S)-4-acetyl-3-methyl-1-piperazinyl]-6-chloro-2-pyrimidinyl]thio]-N-[(2S)-3-methylbutan-2-yl]acetamide IUPAC Name: 2-[4-[(3S)-4-acetyl-3-methylpiperazin-1-yl]-6-chloropyrimidin-2-yl]sulfanyl-N-[(2S)-3-methylbutan-2-yl]acetamide Traditional Name: 2-[[4-[(3S)-4-acetyl-3-methyl-piperazino]-6-chloro-pyrimidin-2-yl]thio]-N-[(1S)-1,2-dimethylpropyl]acetamide Formula: C18H28ClN5O2S MolecularWeight: 413.96522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C)C2=CC(=NC(=N2)SCC(=O)NC(C)C(C)C)Cl

Isomeric SMILES

C[C@H]1CN(CCN1C(=O)C)C2=CC(=NC(=N2)SCC(=O)N[C@@H](C)C(C)C)Cl

InChI

InChI=1S/C18H28ClN5O2S/c1-11(2)13(4)20-17(26)10-27-18-21-15(19)8-16(22-18)23-6-7-24(14(5)25)12(3)9-23/h8,11-13H,6-7,9-10H2,1-5H3,(H,20,26)/t12-,13-/m0/s1