N-(2,6-dimethylphenyl)-2-[4-[(2-ethylphenyl)carbamothioyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[4-[(2-ethylphenyl)carbamothioyl]piperazin-1-yl]ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[4-[(2-ethylphenyl)carbamothioyl]piperazin-1-yl]acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[4-[(2-ethylanilino)-sulfanylidenemethyl]-1-piperazinyl]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[4-[(2-ethylphenyl)carbamothioyl]piperazin-1-yl]acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[4-[(2-ethylphenyl)thiocarbamoyl]piperazino]acetamide Formula: C23H30N4OS MolecularWeight: 410.5755

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)N2CCN(CC2)CC(=O)NC3=C(C=CC=C3C)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)N2CCN(CC2)CC(=O)NC3=C(C=CC=C3C)C

InChI

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