Vitas-M small molecule compound

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

Catalog ID
STK306414
SMILES CC1CCc2c(C1)sc1c2c2nc(nn2cn1)COc1ccc(cc1)[N+](=O)[O-]

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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 C19H17N5O3S MW 395.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N5O3S/c1-11-2-7-14-15(8-11)28-19-17(14)18-21-16(22-23(18)10-20-19)9-27-13-5-3-12(4-6-13)24(25)26/h3-6,10-11H,2,7-9H2,1H3
InChIKey
GIIXFLWDBOWUFL-UHFFFAOYSA-N
Synonyms
676631-66-6
676631666
9methyl2((4nitrophenoxy)methyl)891011tetrahydro(1)benzothieno(32e)(124)triazolo(15c)pyrimidine
CC1CCC2=C(C1)SC3=C2C4=NC(=NN4C=N3)COC5=CC=C(C=C5)(N+)(=O)(O)
CC1CCc2c(C1)sc1c2c2nc(nn2cn1)COc1ccc(cc1)(N+)(=O)(O)
InChI=1SC19H17N5O3Sc111271415(811)281917(14)182116(2223(18)102019)927135312(4613)24(25)26h361011H279H21H3
MFCD04129865
ZINC000002790251
ZINC000002790252

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Available files

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