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2-{[4-amino-5-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(2-chloro-10H-phenothiazin-10-yl)ethanone

Catalog ID
STK583282
SMILES Clc1ccc2c(c1)N(C(=O)CSc1nnc(n1N)c1[nH]nc3c1CCC3)c1c(S2)cccc1

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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 C22H18ClN7OS2 MW 496.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClN7OS2/c23-12-8-9-18-16(10-12)29(15-6-1-2-7-17(15)33-18)19(31)11-32-22-28-27-21(30(22)24)20-13-4-3-5-14(13)25-26-20/h1-2,6-10H,3-5,11,24H2,(H,25,26)
InChIKey
JQEMRLRNFFDHOW-UHFFFAOYSA-N
Synonyms
900260-10-8
2((4amino5(1456tetrahydrocyclopenta(c)pyrazol3yl)124triazol3yl)sulfanyl)1(2chlorophenothiazin10yl)ethanone
2((4amino5(1456tetrahydrocyclopenta(c)pyrazol3yl)4H124triazol3yl)thio)1(2chloro10Hphenothiazin10yl)ethanone
2((4amino5(2456tetrahydrocyclopenta(c)pyrazol3yl)4H124triazol3yl)sulfanyl)1(2chloro10Hphenothiazin10yl)ethanone
2(4AMINO5(456TRIHYDROCYCLOPENTA(21D)PYRAZOL3YL)(124TRIAZOL3YLTHIO))1(2CHLOROPHENOTHIAZIN10YL)ETHAN1ONE
900260108
C1CC2=C(C1)NN=C2C3=NN=C(N3N)SCC(=O)N4C5=CC=CC=C5SC6=C4C=C(C=C6)Cl
Clc1ccc2c(c1)N(C(=O)CSc1nnc(n1N)c1(nH)nc3c1CCC3)c1c(S2)cccc1
Clc1ccc2c(c1)N(C(=O)CSc1nnc(n1N)c1n(nH)c3c1CCC3)c1c(S2)cccc1
InChI=1SC22H18ClN7OS2c2312891816(1012)29(15612717(15)3318)19(31)113222282721(30(22)24)201343514(13)252620h12610H351124H2(H2526)
MFCD07205490
ZINC000009449326
ZINC09449326
ZINC9449326

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Available files

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