2-chloranyl-N-[(2S)-1-(4-ethanoylpiperazin-1-yl)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 2-chloranyl-N-[(2S)-1-(4-ethanoylpiperazin-1-yl)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: N-[(1S)-1-(4-acetylpiperazine-1-carbonyl)-3-methylsulfanyl-propyl]-2-chloro-benzamide CAS Name: N-[(2S)-1-(4-acetyl-1-piperazinyl)-4-(methylthio)-1-oxobutan-2-yl]-2-chlorobenzamide IUPAC Name: N-[(2S)-1-(4-acetylpiperazin-1-yl)-4-methylsulfanyl-1-oxobutan-2-yl]-2-chlorobenzamide Traditional Name: N-[(1S)-1-(4-acetylpiperazine-1-carbonyl)-3-(methylthio)propyl]-2-chloro-benzamide Formula: C18H24ClN3O3S MolecularWeight: 397.91946

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)C(CCSC)NC(=O)C2=CC=CC=C2Cl

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)[C@H](CCSC)NC(=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C18H24ClN3O3S/c1-13(23)21-8-10-22(11-9-21)18(25)16(7-12-26-2)20-17(24)14-5-3-4-6-15(14)19/h3-6,16H,7-12H2,1-2H3,(H,20,24)/t16-/m0/s1