Vitas-M small molecule compound

2-[(4-nitrophenoxy)methyl]-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine

Catalog ID
STL176818
SMILES [O-][N+](=O)c1ccc(cc1)OCc1nn2c(n1)c1c(nc2)sc2c1CCCC2

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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 C18H15N5O3S MW 381.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15N5O3S/c24-23(25)11-5-7-12(8-6-11)26-9-15-20-17-16-13-3-1-2-4-14(13)27-18(16)19-10-22(17)21-15/h5-8,10H,1-4,9H2
InChIKey
CWTPGJSOWYITBE-UHFFFAOYSA-N
Synonyms
676458-97-2
(O)(N+)(=O)c1ccc(cc1)OCc1nn2c(n1)c1c(nc2)sc2c1CCCC2
2((4nitrophenoxy)methyl)891011tetrahydro(1)benzothieno(32e)(124)triazolo(15c)pyrimidine
676458972
C1CCC2=C(C1)C3=C(S2)N=CN4C3=NC(=N4)COC5=CC=C(C=C5)(N+)(=O)(O)
InChI=1SC18H15N5O3Sc2423(25)115712(8611)2691520171613312414(13)2718(16)191022(17)2115h5810H149H2
MFCD04051025
ZINC000002789930
ZINC02789930
ZINC2789930

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Available files

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