Vitas-M small molecule compound

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

Catalog ID
STK574223
SMILES Clc1ccc2c(c1)N(C(=O)CSc1nnc(n1N)c1n[nH]c(c1)C)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 C20H16ClN7OS2 MW 469.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16ClN7OS2/c1-11-8-13(24-23-11)19-25-26-20(28(19)22)30-10-18(29)27-14-4-2-3-5-16(14)31-17-7-6-12(21)9-15(17)27/h2-9H,10,22H2,1H3,(H,23,24)
InChIKey
JBHOXCKGNKUYMT-UHFFFAOYSA-N
Synonyms
879446-05-6
2((4amino5(3methyl1Hpyrazol5yl)4H124triazol3yl)thio)1(2chloro10Hphenothiazin10yl)ethanone
2((4AMINO5(5METHYL1HPYRAZOL3YL)124TRIAZOL3YL)SULFANYL)1(2CHLOROPHENOTHIAZIN10YL)ETHANONE
2((4amino5(5methyl1Hpyrazol3yl)4H124triazol3yl)sulfanyl)1(2chloro10Hphenothiazin10yl)ethanone
2(4AMINO5(3METHYLPYRAZOL5YL)(124TRIAZOL3YLTHIO))1(2CHLOROPHENOTHIAZIN10YL)ETHAN1ONE
879446056
CC1=CC(=NN1)C2=NN=C(N2N)SCC(=O)N3C4=CC=CC=C4SC5=C3C=C(C=C5)Cl
Clc1ccc2c(c1)N(C(=O)CSc1nnc(n1N)c1(nH)nc(c1)C)c1c(S2)cccc1
Clc1ccc2c(c1)N(C(=O)CSc1nnc(n1N)c1n(nH)c(c1)C)c1c(S2)cccc1
InChI=1SC20H16ClN7OS2c111813(242311)19252620(28(19)22)301018(29)2714423516(14)31177612(21)915(17)27h29H1022H21H3(H2324)
MFCD07201720
ZINC000009450814
ZINC09450814
ZINC9450814

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Available files

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