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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > sulfur molecular entity > organosulfur compound > sulfonamide > 2-[(2r,3r,6s)-3-(benzenesulfonamido)-2-(hydroxymethyl)-3,6-dihydro-2h-pyran-6-yl]-n-[(3,4-dichlorophenyl)methyl]acetamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > sulfur molecular entity > sulfur oxoacid derivative > sulfonic acid derivative > sulfonamide > 2-[(2r,3r,6s)-3-(benzenesulfonamido)-2-(hydroxymethyl)-3,6-dihydro-2h-pyran-6-yl]-n-[(3,4-dichlorophenyl)methyl]acetamide
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxoacid derivative > sulfur oxoacid derivative > sulfonic acid derivative > sulfonamide > 2-[(2r,3r,6s)-3-(benzenesulfonamido)-2-(hydroxymethyl)-3,6-dihydro-2h-pyran-6-yl]-n-[(3,4-dichlorophenyl)methyl]acetamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > sulfonamide > 2-[(2r,3r,6s)-3-(benzenesulfonamido)-2-(hydroxymethyl)-3,6-dihydro-2h-pyran-6-yl]-n-[(3,4-dichlorophenyl)methyl]acetamide

Preferred term

2-[(2r,3r,6s)-3-(benzenesulfonamido)-2-(hydroxymethyl)-3,6-dihydro-2h-pyran-6-yl]-n-[(3,4-dichlorophenyl)methyl]acetamide  

Type

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

Broader concept

charge

  • 0

formula

  • C21H22Cl2N2O5S

inchi

  • InChI=1S/C21H22Cl2N2O5S/c22-17-8-6-14(10-18(17)23)12-24-21(27)11-15-7-9-19(20(13-26)30-15)25-31(28,29)16-4-2-1-3-5-16/h1-10,15,19-20,25-26H,11-13H2,(H,24,27)/t15-,19-,20+/m1/s1

inchikey

  • LRDWIZFOJOHHOT-YSGRDPCXSA-N

mass

  • 485.383

monoisotopicmass

  • 484.06265

smiles

  • C1=CC=C(C=C1)S(=O)(=O)N[C@@H]2C=C[C@@H](O[C@H]2CO)CC(=O)NCC3=CC(=C(C=C3)Cl)Cl

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:97236

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