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

Systemtic Name: 1-[(4-butylphenyl)carbamothioyl]-N-(2-hydroxyphenyl)piperidine-4-carboxamide Openeye Name: 1-[(4-butylphenyl)carbamothioyl]-N-(2-hydroxyphenyl)piperidine-4-carboxamide CAS Name: 1-[(4-butylanilino)-sulfanylidenemethyl]-N-(2-hydroxyphenyl)-4-piperidinecarboxamide IUPAC Name: 1-[(4-butylphenyl)carbamothioyl]-N-(2-hydroxyphenyl)piperidine-4-carboxamide Traditional Name: 1-[(4-butylphenyl)thiocarbamoyl]-N-(2-hydroxyphenyl)isonipecotamide Formula: C23H29N3O2S MolecularWeight: 411.56026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)N2CCC(CC2)C(=O)NC3=CC=CC=C3O

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)N2CCC(CC2)C(=O)NC3=CC=CC=C3O

InChI

InChI=1S/C23H29N3O2S/c1-2-3-6-17-9-11-19(12-10-17)24-23(29)26-15-13-18(14-16-26)22(28)25-20-7-4-5-8-21(20)27/h4-5,7-12,18,27H,2-3,6,13-16H2,1H3,(H,24,29)(H,25,28)