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

Systemtic Name: (2S)-3-methyl-2-[[(1R)-2-naphthalen-2-ylsulfanyl-1-pyridin-2-yl-ethyl]amino]butan-1-ol Openeye Name: (2S)-3-methyl-2-[[(1R)-2-(2-naphthylsulfanyl)-1-(2-pyridyl)ethyl]amino]butan-1-ol CAS Name: (2S)-3-methyl-2-[[(1R)-2-(2-naphthalenylthio)-1-(2-pyridinyl)ethyl]amino]-1-butanol IUPAC Name: (2S)-3-methyl-2-[[(1R)-2-naphthalen-2-ylsulfanyl-1-pyridin-2-ylethyl]amino]butan-1-ol Traditional Name: (2S)-3-methyl-2-[[(1R)-2-(2-naphthylthio)-1-(2-pyridyl)ethyl]amino]butan-1-ol Formula: C22H26N2OS MolecularWeight: 366.51964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CO)NC(CSC1=CC2=CC=CC=C2C=C1)C3=CC=CC=N3

Isomeric SMILES

CC(C)[C@@H](CO)N[C@@H](CSC1=CC2=CC=CC=C2C=C1)C3=CC=CC=N3

InChI

InChI=1S/C22H26N2OS/c1-16(2)21(14-25)24-22(20-9-5-6-12-23-20)15-26-19-11-10-17-7-3-4-8-18(17)13-19/h3-13,16,21-22,24-25H,14-15H2,1-2H3/t21-,22+/m1/s1