[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl] N-phenylmorpholine-4-carboximidothioate

Systemtic Name: [2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl] N-phenylmorpholine-4-carboximidothioate Openeye Name: [2-(4-isopropylanilino)-2-oxo-ethyl] N-phenylmorpholine-4-carboximidothioate CAS Name: N-phenyl-4-morpholinecarboximidothioic acid [2-oxo-2-(4-propan-2-ylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(4-propan-2-ylanilino)ethyl] N-phenylmorpholine-4-carboximidothioate Traditional Name: N-phenylmorpholine-4-carboximidothioic acid (2-cumidino-2-keto-ethyl) ester Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O2S/c1-17(2)18-8-10-20(11-9-18)23-21(26)16-28-22(25-12-14-27-15-13-25)24-19-6-4-3-5-7-19/h3-11,17H,12-16H2,1-2H3,(H,23,26)