N-(2-ethylphenyl)-2-[4-[(3-methylphenyl)carbamothioyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(2-ethylphenyl)-2-[4-[(3-methylphenyl)carbamothioyl]piperazin-1-yl]ethanamide Openeye Name: N-(2-ethylphenyl)-2-[4-(m-tolylcarbamothioyl)piperazin-1-yl]acetamide CAS Name: N-(2-ethylphenyl)-2-[4-[(3-methylanilino)-sulfanylidenemethyl]-1-piperazinyl]acetamide IUPAC Name: N-(2-ethylphenyl)-2-[4-[(3-methylphenyl)carbamothioyl]piperazin-1-yl]acetamide Traditional Name: N-(2-ethylphenyl)-2-[4-(m-tolylthiocarbamoyl)piperazino]acetamide Formula: C22H28N4OS MolecularWeight: 396.54892

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CN2CCN(CC2)C(=S)NC3=CC=CC(=C3)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CN2CCN(CC2)C(=S)NC3=CC=CC(=C3)C

InChI

InChI=1S/C22H28N4OS/c1-3-18-8-4-5-10-20(18)24-21(27)16-25-11-13-26(14-12-25)22(28)23-19-9-6-7-17(2)15-19/h4-10,15H,3,11-14,16H2,1-2H3,(H,23,28)(H,24,27)