2-[(1R)-3-azanyl-1-(3-chloranyl-1,2-oxazol-5-yl)propyl]sulfanyl-6-methyl-pyridine-3-carbonitrile

Systemtic Name: 2-[(1R)-3-azanyl-1-(3-chloranyl-1,2-oxazol-5-yl)propyl]sulfanyl-6-methyl-pyridine-3-carbonitrile Openeye Name: 2-[(1R)-3-amino-1-(3-chloroisoxazol-5-yl)propyl]sulfanyl-6-methyl-pyridine-3-carbonitrile CAS Name: 2-[[(1R)-3-amino-1-(3-chloro-5-isoxazolyl)propyl]thio]-6-methyl-3-pyridinecarbonitrile IUPAC Name: 2-[(1R)-3-amino-1-(3-chloro-1,2-oxazol-5-yl)propyl]sulfanyl-6-methylpyridine-3-carbonitrile Traditional Name: 2-[[(1R)-3-amino-1-(3-chloroisoxazol-5-yl)propyl]thio]-6-methyl-nicotinonitrile Formula: C13H13ClN4OS MolecularWeight: 308.78652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C#N)SC(CCN)C2=CC(=NO2)Cl

Isomeric SMILES

CC1=NC(=C(C=C1)C#N)S[C@H](CCN)C2=CC(=NO2)Cl

InChI

InChI=1S/C13H13ClN4OS/c1-8-2-3-9(7-16)13(17-8)20-11(4-5-15)10-6-12(14)18-19-10/h2-3,6,11H,4-5,15H2,1H3/t11-/m1/s1