Vitas-M small molecule compound

6-(4-chlorophenyl)-3-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

Catalog ID
STK566965
SMILES Clc1ccc(cc1)C1=Nn2c(SC1)nnc2c1[nH]nc2c1CCC2

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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 C16H13ClN6S MW 356.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13ClN6S/c17-10-6-4-9(5-7-10)13-8-24-16-21-20-15(23(16)22-13)14-11-2-1-3-12(11)18-19-14/h4-7H,1-3,8H2,(H,18,19)
InChIKey
ULCSNUROIAXSPI-UHFFFAOYSA-N
Synonyms
849921-19-3
6(4chlorophenyl)3(1456tetrahydrocyclopenta(c)pyrazol3yl)7H(124)triazolo(34b)(134)thiadiazine
6(4CHLOROPHENYL)3(1H4H5H6HCYCLOPENTA(C)PYRAZOL3YL)7H(124)TRIAZOLO(34B)(134)THIADIAZINE
6(4chlorophenyl)3(2456tetrahydrocyclopenta(c)pyrazol3yl)7H(124)triazolo(34b)(134)thiadiazine
849921193
C1CC2=C(C1)NN=C2C3=NN=C4N3N=C(CS4)C5=CC=C(C=C5)Cl
Clc1ccc(cc1)C1=Nn2c(SC1)nnc2c1(nH)nc2c1CCC2
Clc1ccc(cc1)C1=Nn2c(SC1)nnc2c1n(nH)c2c1CCC2
InChI=1SC16H13ClN6Sc1710649(5710)1382416212015(23(16)2213)141121312(11)181914h47H138H2(H1819)
MFCD05738486
ZINC000004038546
ZINC04038546
ZINC4038546

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Available files

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