[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl] 4-methyl-N-phenyl-piperazine-1-carboximidothioate

Systemtic Name: [2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl] 4-methyl-N-phenyl-piperazine-1-carboximidothioate Openeye Name: [2-(4-isopropylanilino)-2-oxo-ethyl] 4-methyl-N-phenyl-piperazine-1-carboximidothioate CAS Name: 4-methyl-N-phenyl-1-piperazinecarboximidothioic acid [2-oxo-2-(4-propan-2-ylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(4-propan-2-ylanilino)ethyl] 4-methyl-N-phenylpiperazine-1-carboximidothioate Traditional Name: 4-methyl-N-phenyl-piperazine-1-carboximidothioic acid (2-cumidino-2-keto-ethyl) ester Formula: C23H30N4OS MolecularWeight: 410.5755

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N4OS/c1-18(2)19-9-11-21(12-10-19)24-22(28)17-29-23(25-20-7-5-4-6-8-20)27-15-13-26(3)14-16-27/h4-12,18H,13-17H2,1-3H3,(H,24,28)