[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl] 4-methyl-N-phenyl-piperazine-1-carboximidothioate

Systemtic Name: [2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl] 4-methyl-N-phenyl-piperazine-1-carboximidothioate Openeye Name: [2-oxo-2-(2,4,6-trimethylanilino)ethyl] 4-methyl-N-phenyl-piperazine-1-carboximidothioate CAS Name: 4-methyl-N-phenyl-1-piperazinecarboximidothioic acid [2-oxo-2-(2,4,6-trimethylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,6-trimethylanilino)ethyl] 4-methyl-N-phenylpiperazine-1-carboximidothioate Traditional Name: 4-methyl-N-phenyl-piperazine-1-carboximidothioic acid (2-keto-2-mesidino-ethyl) ester Formula: C23H30N4OS MolecularWeight: 410.5755

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)CSC(=NC2=CC=CC=C2)N3CCN(CC3)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)CSC(=NC2=CC=CC=C2)N3CCN(CC3)C)C

InChI

InChI=1S/C23H30N4OS/c1-17-14-18(2)22(19(3)15-17)25-21(28)16-29-23(24-20-8-6-5-7-9-20)27-12-10-26(4)11-13-27/h5-9,14-15H,10-13,16H2,1-4H3,(H,25,28)