[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl] N-phenylpiperidine-1-carboximidothioate

Systemtic Name: [2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl] N-phenylpiperidine-1-carboximidothioate Openeye Name: [2-(2,6-dimethylanilino)-2-oxo-ethyl] N-phenylpiperidine-1-carboximidothioate CAS Name: N-phenyl-1-piperidinecarboximidothioic acid [2-(2,6-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,6-dimethylanilino)-2-oxoethyl] N-phenylpiperidine-1-carboximidothioate Traditional Name: N-phenylpiperidine-1-carboximidothioic acid [2-(2,6-dimethylanilino)-2-keto-ethyl] ester Formula: C22H27N3OS MolecularWeight: 381.53428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CSC(=NC2=CC=CC=C2)N3CCCCC3

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CSC(=NC2=CC=CC=C2)N3CCCCC3

InChI

InChI=1S/C22H27N3OS/c1-17-10-9-11-18(2)21(17)24-20(26)16-27-22(25-14-7-4-8-15-25)23-19-12-5-3-6-13-19/h3,5-6,9-13H,4,7-8,14-16H2,1-2H3,(H,24,26)