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

Systemtic Name: [2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl] N-phenylmorpholine-4-carboximidothioate Openeye Name: [2-(2,6-dimethylanilino)-2-oxo-ethyl] N-phenylmorpholine-4-carboximidothioate CAS Name: N-phenyl-4-morpholinecarboximidothioic acid [2-(2,6-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,6-dimethylanilino)-2-oxoethyl] N-phenylmorpholine-4-carboximidothioate Traditional Name: N-phenylmorpholine-4-carboximidothioic acid [2-(2,6-dimethylanilino)-2-keto-ethyl] ester Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O2S/c1-16-7-6-8-17(2)20(16)23-19(25)15-27-21(24-11-13-26-14-12-24)22-18-9-4-3-5-10-18/h3-10H,11-15H2,1-2H3,(H,23,25)