N-[(3-chloranyl-4-piperidin-1-yl-phenyl)carbamothioyl]-2-(2-methylphenoxy)ethanamide

Systemtic Name: N-[(3-chloranyl-4-piperidin-1-yl-phenyl)carbamothioyl]-2-(2-methylphenoxy)ethanamide Openeye Name: N-[[3-chloro-4-(1-piperidyl)phenyl]carbamothioyl]-2-(2-methylphenoxy)acetamide CAS Name: N-[[3-chloro-4-(1-piperidinyl)anilino]-sulfanylidenemethyl]-2-(2-methylphenoxy)acetamide IUPAC Name: N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]-2-(2-methylphenoxy)acetamide Traditional Name: N-[(3-chloro-4-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=CC(=C(C=C2)N3CCCCC3)Cl

Isomeric SMILES

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

InChI

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