(2S)-2-acetamido-N-ethyl-N-[[1-(1-methylpiperidin-4-yl)piperidin-4-yl]methyl]-4-methylsulfanyl-butanamide

Systemtic Name: (2S)-2-acetamido-N-ethyl-N-[[1-(1-methylpiperidin-4-yl)piperidin-4-yl]methyl]-4-methylsulfanyl-butanamide Openeye Name: (2S)-2-acetamido-N-ethyl-N-[[1-(1-methyl-4-piperidyl)-4-piperidyl]methyl]-4-methylsulfanyl-butanamide CAS Name: (2S)-2-acetamido-N-ethyl-N-[[1-(1-methyl-4-piperidinyl)-4-piperidinyl]methyl]-4-(methylthio)butanamide IUPAC Name: (2S)-2-acetamido-N-ethyl-N-[[1-(1-methylpiperidin-4-yl)piperidin-4-yl]methyl]-4-methylsulfanylbutanamide Traditional Name: (2S)-2-acetamido-N-ethyl-N-[[1-(1-methyl-4-piperidyl)-4-piperidyl]methyl]-4-(methylthio)butyramide Formula: C21H40N4O2S MolecularWeight: 412.6329

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1CCN(CC1)C2CCN(CC2)C)C(=O)C(CCSC)NC(=O)C

Isomeric SMILES

CCN(CC1CCN(CC1)C2CCN(CC2)C)C(=O)[C@H](CCSC)NC(=O)C

InChI

InChI=1S/C21H40N4O2S/c1-5-24(21(27)20(10-15-28-4)22-17(2)26)16-18-6-13-25(14-7-18)19-8-11-23(3)12-9-19/h18-20H,5-16H2,1-4H3,(H,22,26)/t20-/m0/s1