2-(4-chloranyl-3-methyl-phenoxy)-N-[(2-piperidin-1-ylphenyl)carbamothioyl]ethanamide

Systemtic Name: 2-(4-chloranyl-3-methyl-phenoxy)-N-[(2-piperidin-1-ylphenyl)carbamothioyl]ethanamide Openeye Name: 2-(4-chloro-3-methyl-phenoxy)-N-[[2-(1-piperidyl)phenyl]carbamothioyl]acetamide CAS Name: 2-(4-chloro-3-methylphenoxy)-N-[[2-(1-piperidinyl)anilino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-chloro-3-methylphenoxy)-N-[(2-piperidin-1-ylphenyl)carbamothioyl]acetamide Traditional Name: 2-(4-chloro-3-methyl-phenoxy)-N-[(2-piperidinophenyl)thiocarbamoyl]acetamide Formula: C21H24ClN3O2S MolecularWeight: 417.95216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)NC(=S)NC2=CC=CC=C2N3CCCCC3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)NC(=S)NC2=CC=CC=C2N3CCCCC3)Cl

InChI

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