1-[(2-chloranyl-4,6-dimethyl-phenyl)carbamothioyl]-N-(2-hydroxyphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[(2-chloranyl-4,6-dimethyl-phenyl)carbamothioyl]-N-(2-hydroxyphenyl)piperidine-4-carboxamide Openeye Name: 1-[(2-chloro-4,6-dimethyl-phenyl)carbamothioyl]-N-(2-hydroxyphenyl)piperidine-4-carboxamide CAS Name: 1-[(2-chloro-4,6-dimethylanilino)-sulfanylidenemethyl]-N-(2-hydroxyphenyl)-4-piperidinecarboxamide IUPAC Name: 1-[(2-chloro-4,6-dimethylphenyl)carbamothioyl]-N-(2-hydroxyphenyl)piperidine-4-carboxamide Traditional Name: 1-[(2-chloro-4,6-dimethyl-phenyl)thiocarbamoyl]-N-(2-hydroxyphenyl)isonipecotamide Formula: C21H24ClN3O2S MolecularWeight: 417.95216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)NC(=S)N2CCC(CC2)C(=O)NC3=CC=CC=C3O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)NC(=S)N2CCC(CC2)C(=O)NC3=CC=CC=C3O)C

InChI

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