4-[(1R,3S)-3-azanyl-4-oxidanyl-1-phenyl-butyl]sulfanyl-6-[bis(fluoranyl)methoxy]pyridine-3-carbonitrile

Systemtic Name: 4-[(1R,3S)-3-azanyl-4-oxidanyl-1-phenyl-butyl]sulfanyl-6-[bis(fluoranyl)methoxy]pyridine-3-carbonitrile Openeye Name: 4-[(1R,3S)-3-amino-4-hydroxy-1-phenyl-butyl]sulfanyl-6-(difluoromethoxy)pyridine-3-carbonitrile CAS Name: 4-[[(1R,3S)-3-amino-4-hydroxy-1-phenylbutyl]thio]-6-(difluoromethoxy)-3-pyridinecarbonitrile IUPAC Name: 4-[(1R,3S)-3-amino-4-hydroxy-1-phenylbutyl]sulfanyl-6-(difluoromethoxy)pyridine-3-carbonitrile Traditional Name: 4-[[(1R,3S)-3-amino-4-hydroxy-1-phenyl-butyl]thio]-6-(difluoromethoxy)nicotinonitrile Formula: C17H17F2N3O2S MolecularWeight: 365.397586

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(CO)N)SC2=CC(=NC=C2C#N)OC(F)F

Isomeric SMILES

C1=CC=C(C=C1)[C@@H](C[C@@H](CO)N)SC2=CC(=NC=C2C#N)OC(F)F

InChI

InChI=1S/C17H17F2N3O2S/c18-17(19)24-16-7-15(12(8-20)9-22-16)25-14(6-13(21)10-23)11-4-2-1-3-5-11/h1-5,7,9,13-14,17,23H,6,10,21H2/t13-,14+/m0/s1