[1-[(2-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-naphthalen-2-ylsulfanylethanoate

Systemtic Name: [1-[(2-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-naphthalen-2-ylsulfanylethanoate Openeye Name: [2-(2-cyanoanilino)-1-methyl-2-oxo-ethyl] 2-(2-naphthylsulfanyl)acetate CAS Name: 2-(2-naphthalenylthio)acetic acid [1-(2-cyanoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-cyanoanilino)-1-oxopropan-2-yl] 2-naphthalen-2-ylsulfanylacetate Traditional Name: 2-(2-naphthylthio)acetic acid [2-(2-cyanoanilino)-2-keto-1-methyl-ethyl] ester Formula: C22H18N2O3S MolecularWeight: 390.45492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C#N)OC(=O)CSC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1C#N)OC(=O)CSC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C22H18N2O3S/c1-15(22(26)24-20-9-5-4-8-18(20)13-23)27-21(25)14-28-19-11-10-16-6-2-3-7-17(16)12-19/h2-12,15H,14H2,1H3,(H,24,26)