2-(4-chlorophenyl)-N-[[2-(4-methylsulfonylpiperazin-1-yl)phenyl]carbamothioyl]ethanamide

Systemtic Name: 2-(4-chlorophenyl)-N-[[2-(4-methylsulfonylpiperazin-1-yl)phenyl]carbamothioyl]ethanamide Openeye Name: 2-(4-chlorophenyl)-N-[[2-(4-methylsulfonylpiperazin-1-yl)phenyl]carbamothioyl]acetamide CAS Name: 2-(4-chlorophenyl)-N-[[2-(4-methylsulfonyl-1-piperazinyl)anilino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-chlorophenyl)-N-[[2-(4-methylsulfonylpiperazin-1-yl)phenyl]carbamothioyl]acetamide Traditional Name: 2-(4-chlorophenyl)-N-[[2-(4-mesylpiperazino)phenyl]thiocarbamoyl]acetamide Formula: C20H23ClN4O3S2 MolecularWeight: 467.00462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C2=CC=CC=C2NC(=S)NC(=O)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C2=CC=CC=C2NC(=S)NC(=O)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H23ClN4O3S2/c1-30(27,28)25-12-10-24(11-13-25)18-5-3-2-4-17(18)22-20(29)23-19(26)14-15-6-8-16(21)9-7-15/h2-9H,10-14H2,1H3,(H2,22,23,26,29)