N-[(3-chloranyl-2-piperidin-1-yl-phenyl)carbamothioyl]-2-(2-methylphenoxy)ethanamide

Systemtic Name: N-[(3-chloranyl-2-piperidin-1-yl-phenyl)carbamothioyl]-2-(2-methylphenoxy)ethanamide Openeye Name: N-[[3-chloro-2-(1-piperidyl)phenyl]carbamothioyl]-2-(2-methylphenoxy)acetamide CAS Name: N-[[3-chloro-2-(1-piperidinyl)anilino]-sulfanylidenemethyl]-2-(2-methylphenoxy)acetamide IUPAC Name: N-[(3-chloro-2-piperidin-1-ylphenyl)carbamothioyl]-2-(2-methylphenoxy)acetamide Traditional Name: N-[(3-chloro-2-piperidino-phenyl)thiocarbamoyl]-2-(2-methylphenoxy)acetamide Formula: C21H24ClN3O2S MolecularWeight: 417.95216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(=O)NC(=S)NC2=C(C(=CC=C2)Cl)N3CCCCC3

Isomeric SMILES

CC1=CC=CC=C1OCC(=O)NC(=S)NC2=C(C(=CC=C2)Cl)N3CCCCC3

InChI

InChI=1S/C21H24ClN3O2S/c1-15-8-3-4-11-18(15)27-14-19(26)24-21(28)23-17-10-7-9-16(22)20(17)25-12-5-2-6-13-25/h3-4,7-11H,2,5-6,12-14H2,1H3,(H2,23,24,26,28)