2-[4-(cyclopentylcarbamothioyl)piperazin-1-yl]-N-(4-methylphenyl)ethanamide; ethanoic acid

Systemtic Name: 2-[4-(cyclopentylcarbamothioyl)piperazin-1-yl]-N-(4-methylphenyl)ethanamide; ethanoic acid Openeye Name: acetic acid; 2-[4-(cyclopentylcarbamothioyl)piperazin-1-yl]-N-(p-tolyl)acetamide CAS Name: acetic acid; 2-[4-[(cyclopentylamino)-sulfanylidenemethyl]-1-piperazinyl]-N-(4-methylphenyl)acetamide IUPAC Name: acetic acid; 2-[4-(cyclopentylcarbamothioyl)piperazin-1-yl]-N-(4-methylphenyl)acetamide Traditional Name: acetic acid; 2-[4-(cyclopentylthiocarbamoyl)piperazino]-N-(p-tolyl)acetamide Formula: C21H32N4O3S MolecularWeight: 420.56878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CN2CCN(CC2)C(=S)NC3CCCC3.CC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN2CCN(CC2)C(=S)NC3CCCC3.CC(=O)O

InChI

InChI=1S/C19H28N4OS.C2H4O2/c1-15-6-8-17(9-7-15)20-18(24)14-22-10-12-23(13-11-22)19(25)21-16-4-2-3-5-16;1-2(3)4/h6-9,16H,2-5,10-14H2,1H3,(H,20,24)(H,21,25);1H3,(H,3,4)