Vitas-M small molecule compound
2-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-7-phenyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STK864636
SMILES c1ccc(cc1)n1ncc2c1ncn1c2nc(n1)CSc1nc2c(s1)cccc2
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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 C20H13N7S2 MW 415.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13N7S2/c1-2-6-13(7-3-1)27-18-14(10-22-27)19-24-17(25-26(19)12-21-18)11-28-20-23-15-8-4-5-9-16(15)29-20/h1-10,12H,11H2InChIKey
HKEDVODTIQPIFI-UHFFFAOYSA-NSynonyms
488109-41-72(((7phenyl7Hpyrazolo(43e)(124)triazolo(15c)pyrimidin2yl)methyl)thio)benzo(d)thiazole
2((13benzothiazol2ylsulfanyl)methyl)7phenyl7Hpyrazolo(43e)(124)triazolo(15c)pyrimidine
488109417
C1=CC=C(C=C1)N2C3=C(C=N2)C4=NC(=NN4C=N3)CSC5=NC6=CC=CC=C6S5
InChI=1SC20H13N7S2c12613(731)271814(102227)192417(2526(19)122118)1128202315845916(15)2920h11012H11H2
MFCD03289024
ZINC000001000822
ZINC01000822
ZINC1000822
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