[(2R,3R)-1-naphthalen-1-yl-1-oxidanylidene-3-phenyl-3-phenylazanyl-propan-2-yl] thiocyanate

Systemtic Name: [(2R,3R)-1-naphthalen-1-yl-1-oxidanylidene-3-phenyl-3-phenylazanyl-propan-2-yl] thiocyanate Openeye Name: [(1R)-1-[(R)-anilino(phenyl)methyl]-2-(1-naphthyl)-2-oxo-ethyl] thiocyanate CAS Name: thiocyanic acid [(1R,2R)-1-anilino-3-(1-naphthalenyl)-3-oxo-1-phenylpropan-2-yl] ester IUPAC Name: [(1R,2R)-1-anilino-3-naphthalen-1-yl-3-oxo-1-phenylpropan-2-yl] thiocyanate Traditional Name: thiocyanic acid [(1R)-1-[(R)-anilino(phenyl)methyl]-2-keto-2-(1-naphthyl)ethyl] ester Formula: C26H20N2OS MolecularWeight: 408.5148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(C(=O)C2=CC=CC3=CC=CC=C32)SC#N)NC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)[C@H]([C@H](C(=O)C2=CC=CC3=CC=CC=C32)SC#N)NC4=CC=CC=C4

InChI

InChI=1S/C26H20N2OS/c27-18-30-26(25(29)23-17-9-13-19-10-7-8-16-22(19)23)24(20-11-3-1-4-12-20)28-21-14-5-2-6-15-21/h1-17,24,26,28H/t24-,26-/m1/s1