N-(2,6-dimethylphenyl)-2-[4-(propan-2-ylcarbamothioyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[4-(propan-2-ylcarbamothioyl)piperazin-1-yl]ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[4-(isopropylcarbamothioyl)piperazin-1-yl]acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[4-[(propan-2-ylamino)-sulfanylidenemethyl]-1-piperazinyl]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[4-(propan-2-ylcarbamothioyl)piperazin-1-yl]acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[4-(isopropylthiocarbamoyl)piperazino]acetamide Formula: C18H28N4OS MolecularWeight: 348.50612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)C(=S)NC(C)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)C(=S)NC(C)C

InChI

InChI=1S/C18H28N4OS/c1-13(2)19-18(24)22-10-8-21(9-11-22)12-16(23)20-17-14(3)6-5-7-15(17)4/h5-7,13H,8-12H2,1-4H3,(H,19,24)(H,20,23)