2-(2-methylphenyl)-N-[(4-piperidin-1-ylcarbonylphenyl)carbamothioyl]ethanamide

Systemtic Name: 2-(2-methylphenyl)-N-[(4-piperidin-1-ylcarbonylphenyl)carbamothioyl]ethanamide Openeye Name: 2-(o-tolyl)-N-[[4-(piperidine-1-carbonyl)phenyl]carbamothioyl]acetamide CAS Name: 2-(2-methylphenyl)-N-[[4-[oxo(1-piperidinyl)methyl]anilino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(2-methylphenyl)-N-[[4-(piperidine-1-carbonyl)phenyl]carbamothioyl]acetamide Traditional Name: 2-(o-tolyl)-N-[[4-(piperidine-1-carbonyl)phenyl]thiocarbamoyl]acetamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(=O)NC(=S)NC2=CC=C(C=C2)C(=O)N3CCCCC3

Isomeric SMILES

CC1=CC=CC=C1CC(=O)NC(=S)NC2=CC=C(C=C2)C(=O)N3CCCCC3

InChI

InChI=1S/C22H25N3O2S/c1-16-7-3-4-8-18(16)15-20(26)24-22(28)23-19-11-9-17(10-12-19)21(27)25-13-5-2-6-14-25/h3-4,7-12H,2,5-6,13-15H2,1H3,(H2,23,24,26,28)