2-[4-[(5-chloranyl-2-methoxy-phenyl)carbamothioyl]piperazin-1-yl]-N-methyl-N-phenyl-ethanamide

Systemtic Name: 2-[4-[(5-chloranyl-2-methoxy-phenyl)carbamothioyl]piperazin-1-yl]-N-methyl-N-phenyl-ethanamide Openeye Name: 2-[4-[(5-chloro-2-methoxy-phenyl)carbamothioyl]piperazin-1-yl]-N-methyl-N-phenyl-acetamide CAS Name: 2-[4-[(5-chloro-2-methoxyanilino)-sulfanylidenemethyl]-1-piperazinyl]-N-methyl-N-phenylacetamide IUPAC Name: 2-[4-[(5-chloro-2-methoxyphenyl)carbamothioyl]piperazin-1-yl]-N-methyl-N-phenylacetamide Traditional Name: 2-[4-[(5-chloro-2-methoxy-phenyl)thiocarbamoyl]piperazino]-N-methyl-N-phenyl-acetamide Formula: C21H25ClN4O2S MolecularWeight: 432.9668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25ClN4O2S/c1-24(17-6-4-3-5-7-17)20(27)15-25-10-12-26(13-11-25)21(29)23-18-14-16(22)8-9-19(18)28-2/h3-9,14H,10-13,15H2,1-2H3,(H,23,29)