(1R)-4-(methylamino)-3-[(R)-(4-methylphenyl)sulfinyl]-1-pyridin-3-yl-butan-1-ol

Systemtic Name: (1R)-4-(methylamino)-3-[(R)-(4-methylphenyl)sulfinyl]-1-pyridin-3-yl-butan-1-ol Openeye Name: (1R)-4-(methylamino)-3-[(R)-p-tolylsulfinyl]-1-(3-pyridyl)butan-1-ol CAS Name: (1R)-4-(methylamino)-3-[(R)-(4-methylphenyl)sulfinyl]-1-(3-pyridinyl)-1-butanol IUPAC Name: (1R)-4-(methylamino)-3-[(R)-(4-methylphenyl)sulfinyl]-1-pyridin-3-ylbutan-1-ol Traditional Name: (1R)-4-(methylamino)-3-[(R)-p-tolylsulfinyl]-1-(3-pyridyl)butan-1-ol Formula: C17H22N2O2S MolecularWeight: 318.43378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)C(CC(C2=CN=CC=C2)O)CNC

Isomeric SMILES

CC1=CC=C(C=C1)[S@](=O)C(C[C@H](C2=CN=CC=C2)O)CNC

InChI

InChI=1S/C17H22N2O2S/c1-13-5-7-15(8-6-13)22(21)16(12-18-2)10-17(20)14-4-3-9-19-11-14/h3-9,11,16-18,20H,10,12H2,1-2H3/t16?,17-,22+/m1/s1