skip to main content

Chemistry, part 3

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > sulfur molecular entity > organosulfur compound > thiocarbonyl compound > thioureas > 1-(1-adamantyl)-3-(3,4-dimethoxyphenyl)thiourea
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organosulfur compound > thiocarbonyl compound > thioureas > 1-(1-adamantyl)-3-(3,4-dimethoxyphenyl)thiourea
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organosulfur compound > thiocarbonyl compound > thioureas > 1-(1-adamantyl)-3-(3,4-dimethoxyphenyl)thiourea

Preferred term

1-(1-adamantyl)-3-(3,4-dimethoxyphenyl)thiourea  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C19H26N2O2S

inchi

  • InChI=1S/C19H26N2O2S/c1-22-16-4-3-15(8-17(16)23-2)20-18(24)21-19-9-12-5-13(10-19)7-14(6-12)11-19/h3-4,8,12-14H,5-7,9-11H2,1-2H3,(H2,20,21,24)

inchikey

  • NESZUUSZWXHIBH-UHFFFAOYSA-N

mass

  • 346.489

monoisotopicmass

  • 346.17150

smiles

  • COC1=C(C=C(C=C1)NC(=S)NC23CC4CC(C2)CC(C4)C3)OC

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:123405

Download this concept:

RDF/XML TURTLE JSON-LD