Vitas-M small molecule compound
3-(4-methoxyphenyl)-6-(4-nitrophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Catalog ID
STL071427
SMILES COc1ccc(cc1)c1nnc2n1N=C(CS2)c1ccc(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 C17H13N5O3S MW 367.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N5O3S/c1-25-14-8-4-12(5-9-14)16-18-19-17-21(16)20-15(10-26-17)11-2-6-13(7-3-11)22(23)24/h2-9H,10H2,1H3InChIKey
IPUTURIHBNPFBF-UHFFFAOYSA-NSynonyms
85106-43-03(4methoxyphenyl)6(4nitrophenyl)7H(124)triazolo(34b)(134)thiadiazine
4METHOXY1(6(4NITROPHENYL)(7H124TRIAZOLO(34B)134THIADIAZIN3YL))BENZENE
85106430
COC1=CC=C(C=C1)C2=NN=C3N2N=C(CS3)C4=CC=C(C=C4)(N+)(=O)(O)
COc1ccc(cc1)c1nnc2n1N=C(CS2)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC17H13N5O3Sc125148412(5914)1618191721(16)2015(102617)112613(7311)22(23)24h29H10H21H3
MFCD05692201
ZINC000001314777
ZINC01314777
ZINC1314777
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