Vitas-M small molecule compound
3-methyl-6-{[(4-nitrophenyl)sulfonyl]methyl}-6,7-dihydro-4H-[1,3]thiazolo[2,3-c][1,2,4]triazin-4-one
Catalog ID
STK208718
SMILES [O-][N+](=O)c1ccc(cc1)S(=O)(=O)CC1CSc2n1c(=O)c(nn2)C
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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 C13H12N4O5S2 MW 368.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12N4O5S2/c1-8-12(18)16-10(6-23-13(16)15-14-8)7-24(21,22)11-4-2-9(3-5-11)17(19)20/h2-5,10H,6-7H2,1H3InChIKey
KGWMJPSAUOEZSB-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc(cc1)S(=O)(=O)CC1CSc2n1c(=O)c(nn2)C
3METHYL6(((4NITROPHENYL)SULFONYL)METHYL)67DIHYDRO4H(13)THIAZOLO(23C)(124)TRIAZIN4ONE
3methyl6((4nitrophenyl)sulfonylmethyl)67dihydro(13)thiazolo(23c)(124)triazin4one
CC1=NN=C2N(C1=O)C(CS2)CS(=O)(=O)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC13H12N4O5S2c1812(18)1610(62313(16)15148)724(2122)11429(3511)17(19)20h2510H67H21H3
MFCD06193752
ZINC000010034870
ZINC000010034871
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