Vitas-M small molecule compound
6-(3-methyl-4-nitrophenyl)-3-[(phenylsulfanyl)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STK238808
SMILES [O-][N+](=O)c1ccc(cc1C)c1nn2c(s1)nnc2CSc1ccccc1
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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 C17H13N5O2S2 MW 383.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N5O2S2/c1-11-9-12(7-8-14(11)22(23)24)16-20-21-15(18-19-17(21)26-16)10-25-13-5-3-2-4-6-13/h2-9H,10H2,1H3InChIKey
LDGJYULRQUEKQU-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc(cc1C)c1nn2c(s1)nnc2CSc1ccccc1
6(3methyl4nitrophenyl)3((phenylsulfanyl)methyl)(124)triazolo(34b)(134)thiadiazole
6(3methyl4nitrophenyl)3(phenylsulfanylmethyl)(124)triazolo(34b)(134)thiadiazole
CC1=C(C=CC(=C1)C2=NN3C(=NN=C3S2)CSC4=CC=CC=C4)(N+)(=O)(O)
InChI=1SC17H13N5O2S2c111912(7814(11)22(23)24)16202115(181917(21)2616)1025135324613h29H10H21H3
MFCD08684063
ZINC000008393140
ZINC08393140
ZINC8393140
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