N-[(2S)-1-methoxy-3-phenyl-propan-2-yl]-2-methylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[(2S)-1-methoxy-3-phenyl-propan-2-yl]-2-methylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[(1S)-1-benzyl-2-methoxy-ethyl]-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: N-[(2S)-1-methoxy-3-phenylpropan-2-yl]-2-(methylthio)-3-pyridinecarboxamide IUPAC Name: N-[(2S)-1-methoxy-3-phenylpropan-2-yl]-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-[(1S)-1-benzyl-2-methoxy-ethyl]-2-(methylthio)nicotinamide Formula: C17H20N2O2S MolecularWeight: 316.4179

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Descriptors Computed from Structure

Canonical SMILES:

COCC(CC1=CC=CC=C1)NC(=O)C2=C(N=CC=C2)SC

Isomeric SMILES

COC[C@H](CC1=CC=CC=C1)NC(=O)C2=C(N=CC=C2)SC

InChI

InChI=1S/C17H20N2O2S/c1-21-12-14(11-13-7-4-3-5-8-13)19-16(20)15-9-6-10-18-17(15)22-2/h3-10,14H,11-12H2,1-2H3,(H,19,20)/t14-/m0/s1