Vitas-M small molecule compound

5-[(1,3-benzoxazol-2-ylsulfanyl)methyl]-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one

Catalog ID
STK285136
SMILES O=c1cc(CSc2nc3c(o2)cccc3)[nH]c2n1nc(n2)c1ccccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C19H13N5O2S MW 375.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13N5O2S/c25-16-10-13(11-27-19-21-14-8-4-5-9-15(14)26-19)20-18-22-17(23-24(16)18)12-6-2-1-3-7-12/h1-10H,11H2,(H,20,22,23)
InChIKey
NCJMWDWSLNVBEG-UHFFFAOYSA-N
Synonyms
921104-72-5
5((13benzoxazol2ylsulfanyl)methyl)2phenyl(124)triazolo(15a)pyrimidin7(4H)one
5((benzo(d)oxazol2ylthio)methyl)2phenyl(124)triazolo(15a)pyrimidin7(4H)one
5(13benzoxazol2ylsulfanylmethyl)2phenyl1H(124)triazolo(15a)pyrimidin7one
5(BENZOXAZOL2YLTHIOMETHYL)2PHENYL48DIHYDRO124TRIAZOLO(15A)PYRIMIDIN7ONE
921104725
C1=CC=C(C=C1)C2=NC3=NC(=CC(=O)N3N2)CSC4=NC5=CC=CC=C5O4
InChI=1SC19H13N5O2Sc25161013(1127192114845915(14)2619)20182217(2324(16)18)126213712h110H11H2(H202223)
MFCD08719203
O=c1cc(CSc2nc3c(o2)cccc3)(nH)c2n1nc(n2)c1ccccc1
ZINC000100071878
ZINC100071878
ZINC9936163

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Available files

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