N-[(2S)-1-[4-(hydroxymethyl)-4-phenethyl-piperidin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]ethanamide

Systemtic Name: N-[(2S)-1-[4-(hydroxymethyl)-4-phenethyl-piperidin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]ethanamide Openeye Name: N-[(1S)-1-[4-(hydroxymethyl)-4-phenethyl-piperidine-1-carbonyl]-3-methylsulfanyl-propyl]acetamide CAS Name: N-[(2S)-1-[4-(hydroxymethyl)-4-phenethyl-1-piperidinyl]-4-(methylthio)-1-oxobutan-2-yl]acetamide IUPAC Name: N-[(2S)-1-[4-(hydroxymethyl)-4-phenethylpiperidin-1-yl]-4-methylsulfanyl-1-oxobutan-2-yl]acetamide Traditional Name: N-[(1S)-1-(4-methylol-4-phenethyl-piperidine-1-carbonyl)-3-(methylthio)propyl]acetamide Formula: C21H32N2O3S MolecularWeight: 392.55538

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCSC)C(=O)N1CCC(CC1)(CCC2=CC=CC=C2)CO

Isomeric SMILES

CC(=O)N[C@@H](CCSC)C(=O)N1CCC(CC1)(CCC2=CC=CC=C2)CO

InChI

InChI=1S/C21H32N2O3S/c1-17(25)22-19(9-15-27-2)20(26)23-13-11-21(16-24,12-14-23)10-8-18-6-4-3-5-7-18/h3-7,19,24H,8-16H2,1-2H3,(H,22,25)/t19-/m0/s1