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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCC(=O)NC(=S)NC2=CC=C(C=C2)N3CCCCC3

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCC(=O)NC(=S)NC2=CC=C(C=C2)N3CCCCC3

InChI

InChI=1S/C21H24ClN3O2S/c1-15-13-16(22)5-10-19(15)27-14-20(26)24-21(28)23-17-6-8-18(9-7-17)25-11-3-2-4-12-25/h5-10,13H,2-4,11-12,14H2,1H3,(H2,23,24,26,28)