2-(2,5-dimethylphenoxy)-N-[(4-piperidin-1-ylphenyl)carbamothioyl]ethanamide

Systemtic Name: 2-(2,5-dimethylphenoxy)-N-[(4-piperidin-1-ylphenyl)carbamothioyl]ethanamide Openeye Name: 2-(2,5-dimethylphenoxy)-N-[[4-(1-piperidyl)phenyl]carbamothioyl]acetamide CAS Name: 2-(2,5-dimethylphenoxy)-N-[[4-(1-piperidinyl)anilino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(2,5-dimethylphenoxy)-N-[(4-piperidin-1-ylphenyl)carbamothioyl]acetamide Traditional Name: 2-(2,5-dimethylphenoxy)-N-[(4-piperidinophenyl)thiocarbamoyl]acetamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O2S/c1-16-6-7-17(2)20(14-16)27-15-21(26)24-22(28)23-18-8-10-19(11-9-18)25-12-4-3-5-13-25/h6-11,14H,3-5,12-13,15H2,1-2H3,(H2,23,24,26,28)