Vitas-M small molecule compound
(3bS,4aR)-1-(1,3-benzothiazol-2-yl)-3,4,4-trimethyl-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazole
Catalog ID
STK538368
SMILES Cc1nn(c2c1[C@H]1[C@@H](C2)C1(C)C)c1nc2c(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 C17H17N3S MW 295.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3S/c1-9-14-12(8-10-15(14)17(10,2)3)20(19-9)16-18-11-6-4-5-7-13(11)21-16/h4-7,10,15H,8H2,1-3H3/t10-,15-/m1/s1InChIKey
PEWQZQHRQXWYOD-MEBBXXQBSA-NSynonyms
448207-18-9(3bS4aR)1(13benzothiazol2yl)344trimethyl3b44a5tetrahydro1Hcyclopropa(34)cyclopenta(12c)pyrazole
2((3bS4aR)344trimethyl3b44a5tetrahydro1Hcyclopropa(34)cyclopenta(12c)pyrazol1yl)benzo(d)thiazole
448207189
CC1=NN(C2=C1C3C(C2)C3(C)C)C4=NC5=CC=CC=C5S4
Cc1nn(c2c1(C@H)1(C@@H)(C2)C1(C)C)c1nc2c(s1)cccc2
InChI=1SC17H17N3Sc191412(81015(14)17(102)3)20(199)161811645713(11)2116h471015H8H213H3t1015m1s1
MFCD18241705
ZINC000000524387
ZINC00524387
ZINC524387
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