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

Systemtic Name: N-[(2S)-1-(azocan-1-yl)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2,4-bis(chloranyl)benzamide Openeye Name: N-[(1S)-1-(azocane-1-carbonyl)-3-methylsulfanyl-propyl]-2,4-dichloro-benzamide CAS Name: N-[(2S)-1-(1-azocanyl)-4-(methylthio)-1-oxobutan-2-yl]-2,4-dichlorobenzamide IUPAC Name: N-[(2S)-1-(azocan-1-yl)-4-methylsulfanyl-1-oxobutan-2-yl]-2,4-dichlorobenzamide Traditional Name: N-[(1S)-1-(azocane-1-carbonyl)-3-(methylthio)propyl]-2,4-dichloro-benzamide Formula: C19H26Cl2N2O2S MolecularWeight: 417.39294

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)N1CCCCCCC1)NC(=O)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CSCC[C@@H](C(=O)N1CCCCCCC1)NC(=O)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C19H26Cl2N2O2S/c1-26-12-9-17(19(25)23-10-5-3-2-4-6-11-23)22-18(24)15-8-7-14(20)13-16(15)21/h7-8,13,17H,2-6,9-12H2,1H3,(H,22,24)/t17-/m0/s1