2-[4-[(3-methoxyphenyl)carbamothioyl]piperazin-1-yl]-N-methyl-N-phenyl-ethanamide

Systemtic Name: 2-[4-[(3-methoxyphenyl)carbamothioyl]piperazin-1-yl]-N-methyl-N-phenyl-ethanamide Openeye Name: 2-[4-[(3-methoxyphenyl)carbamothioyl]piperazin-1-yl]-N-methyl-N-phenyl-acetamide CAS Name: 2-[4-[(3-methoxyanilino)-sulfanylidenemethyl]-1-piperazinyl]-N-methyl-N-phenylacetamide IUPAC Name: 2-[4-[(3-methoxyphenyl)carbamothioyl]piperazin-1-yl]-N-methyl-N-phenylacetamide Traditional Name: 2-[4-[(3-methoxyphenyl)thiocarbamoyl]piperazino]-N-methyl-N-phenyl-acetamide Formula: C21H26N4O2S MolecularWeight: 398.52174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C(=O)CN2CCN(CC2)C(=S)NC3=CC(=CC=C3)OC

Isomeric SMILES

CN(C1=CC=CC=C1)C(=O)CN2CCN(CC2)C(=S)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C21H26N4O2S/c1-23(18-8-4-3-5-9-18)20(26)16-24-11-13-25(14-12-24)21(28)22-17-7-6-10-19(15-17)27-2/h3-10,15H,11-14,16H2,1-2H3,(H,22,28)