[2-(cyclohexylmethylamino)-2-oxidanylidene-ethyl] 2-phenylsulfanylethanoate

Systemtic Name: [2-(cyclohexylmethylamino)-2-oxidanylidene-ethyl] 2-phenylsulfanylethanoate Openeye Name: [2-(cyclohexylmethylamino)-2-oxo-ethyl] 2-phenylsulfanylacetate CAS Name: 2-(phenylthio)acetic acid [2-(cyclohexylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclohexylmethylamino)-2-oxoethyl] 2-phenylsulfanylacetate Traditional Name: 2-(phenylthio)acetic acid [2-(cyclohexylmethylamino)-2-keto-ethyl] ester Formula: C17H23NO3S MolecularWeight: 321.43442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC(=O)COC(=O)CSC2=CC=CC=C2

Isomeric SMILES

C1CCC(CC1)CNC(=O)COC(=O)CSC2=CC=CC=C2

InChI

InChI=1S/C17H23NO3S/c19-16(18-11-14-7-3-1-4-8-14)12-21-17(20)13-22-15-9-5-2-6-10-15/h2,5-6,9-10,14H,1,3-4,7-8,11-13H2,(H,18,19)