(2S)-3-methyl-2-[[(1R)-2-(phenylmethylsulfanyl)-1-pyridin-2-yl-ethyl]amino]butan-1-ol

Systemtic Name: (2S)-3-methyl-2-[[(1R)-2-(phenylmethylsulfanyl)-1-pyridin-2-yl-ethyl]amino]butan-1-ol Openeye Name: (2S)-2-[[(1R)-2-benzylsulfanyl-1-(2-pyridyl)ethyl]amino]-3-methyl-butan-1-ol CAS Name: (2S)-3-methyl-2-[[(1R)-2-(phenylmethylthio)-1-(2-pyridinyl)ethyl]amino]-1-butanol IUPAC Name: (2S)-2-[[(1R)-2-benzylsulfanyl-1-pyridin-2-ylethyl]amino]-3-methylbutan-1-ol Traditional Name: (2S)-2-[[(1R)-2-(benzylthio)-1-(2-pyridyl)ethyl]amino]-3-methyl-butan-1-ol Formula: C19H26N2OS MolecularWeight: 330.48754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CO)NC(CSCC1=CC=CC=C1)C2=CC=CC=N2

Isomeric SMILES

CC(C)[C@@H](CO)N[C@@H](CSCC1=CC=CC=C1)C2=CC=CC=N2

InChI

InChI=1S/C19H26N2OS/c1-15(2)18(12-22)21-19(17-10-6-7-11-20-17)14-23-13-16-8-4-3-5-9-16/h3-11,15,18-19,21-22H,12-14H2,1-2H3/t18-,19+/m1/s1