1-[(4-ethylphenyl)carbamothioyl]-N-(2-hydroxyphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[(4-ethylphenyl)carbamothioyl]-N-(2-hydroxyphenyl)piperidine-4-carboxamide Openeye Name: 1-[(4-ethylphenyl)carbamothioyl]-N-(2-hydroxyphenyl)piperidine-4-carboxamide CAS Name: 1-[(4-ethylanilino)-sulfanylidenemethyl]-N-(2-hydroxyphenyl)-4-piperidinecarboxamide IUPAC Name: 1-[(4-ethylphenyl)carbamothioyl]-N-(2-hydroxyphenyl)piperidine-4-carboxamide Traditional Name: 1-[(4-ethylphenyl)thiocarbamoyl]-N-(2-hydroxyphenyl)isonipecotamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=S)N2CCC(CC2)C(=O)NC3=CC=CC=C3O

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=S)N2CCC(CC2)C(=O)NC3=CC=CC=C3O

InChI

InChI=1S/C21H25N3O2S/c1-2-15-7-9-17(10-8-15)22-21(27)24-13-11-16(12-14-24)20(26)23-18-5-3-4-6-19(18)25/h3-10,16,25H,2,11-14H2,1H3,(H,22,27)(H,23,26)