[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl] N-phenylmorpholine-4-carboximidothioate

Systemtic Name: [2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl] N-phenylmorpholine-4-carboximidothioate Openeye Name: [2-oxo-2-(2,4,6-trimethylanilino)ethyl] N-phenylmorpholine-4-carboximidothioate CAS Name: N-phenyl-4-morpholinecarboximidothioic acid [2-oxo-2-(2,4,6-trimethylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,6-trimethylanilino)ethyl] N-phenylmorpholine-4-carboximidothioate Traditional Name: N-phenylmorpholine-4-carboximidothioic acid (2-keto-2-mesidino-ethyl) ester Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)CSC(=NC2=CC=CC=C2)N3CCOCC3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)CSC(=NC2=CC=CC=C2)N3CCOCC3)C

InChI

InChI=1S/C22H27N3O2S/c1-16-13-17(2)21(18(3)14-16)24-20(26)15-28-22(25-9-11-27-12-10-25)23-19-7-5-4-6-8-19/h4-8,13-14H,9-12,15H2,1-3H3,(H,24,26)