OntologieschebiclassesCHEBI:4379   
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delavirdine mesylate
http://purl.obolibrary.org/obo/CHEBI_4379

The monomethanesulfonic acid salt of delavirdine, a non-nucleoside reverse transcriptase inhibitor with activity specific for HIV-1. Viral resistance emerges rapidly when delavirdine is used alone, so it is therefore used (as the methanesulfonic acid salt) with other antiretrovirals for combination therapy of HIV infection.

Also appears inslm
Exact Synonyms
DELAVIRDINE MESYLATE
Delavirdine mesylate
N-[2-({4-[3-(propan-2-ylamino)pyridin-2-yl]piperazin-1-yl}carbonyl)-1H-indol-5-yl]methanesulfonamide methanesulfonate
Related Synonyms
1-(3-(isopropylamino)-2-pyridyl)-4-((5-methanesulfonamidoindol-2-yl)carbonyl)piperazine monomethanesulfonate
Delavirdine mesilate
delavirdine mesilate
delavirdine methanesulfonate
delavirdine monomethanesulfonate
N-{2-[4-(3-Isopropylamino-pyridin-2-yl)-piperazine-1-carbonyl]-1H-indol-5-yl}-methanesulfonamide; compound with methanesulfonic acid
class Information
charge

0

formula

C23H32N6O6S2

has_alternative_id
has_dbxref
has_obo_namespace

chebi_ontology

inchikey

MEPNHSOMXMALDZ-UHFFFAOYSA-N

inchi

InChI=1S/C22H28N6O3S.CH4O3S/c1-15(2)24-19-5-4-8-23-21(19)27-9-11-28(12-10-27)22(29)20-14-16-13-17(26-32(3,30)31)6-7-18(16)25-20;1-5(2,3)4/h4-8,13-15,24-26H,9-12H2,1-3H3;1H3,(H,2,3,4)

in_subset

3_STAR

mass

552.66700

monoisotopicmass

552.18248

smiles

CS(O)(=O)=O.CC(C)Nc1cccnc1N1CCN(CC1)C(=O)c1cc2cc(NS(C)(=O)=O)ccc2[nH]1

class Relations