Vitas-M small molecule compound

N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)acetamide

Catalog ID
STK737675
SMILES O=C(Nc1c(C)n(n(c1=O)c1ccccc1)C)CSc1nnc2c(n1)[nH]c1c2cccc1

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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 C22H19N7O2S MW 445.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N7O2S/c1-13-18(21(31)29(28(13)2)14-8-4-3-5-9-14)24-17(30)12-32-22-25-20-19(26-27-22)15-10-6-7-11-16(15)23-20/h3-11H,12H2,1-2H3,(H,24,30)(H,23,25,27)
InChIKey
BUKRRHTUJABFHX-UHFFFAOYSA-N
Synonyms
354990-75-3
354990753
CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CSC3=NC4=C(C5=CC=CC=C5N4)N=N3
InChI=1SC22H19N7O2Sc11318(21(31)29(28(13)2)148435914)2417(30)123222252019(262722)1510671116(15)2320h311H12H212H3(H2430)(H232527)
MFCD01567639
N(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)2(5H(124)triazino(56b)indol3ylsulfanyl)acetamide
N(15DIMETHYL3OXO2PHENYLPYRAZOL4YL)2(5H(124)TRIAZINO(56B)INDOL3YLSULFANYL)ACETAMIDE
N(23DIMETHYL5OXO1PHENYL(3PYRAZOLIN4YL))2(124TRIAZINO(56B)INDOL3YLTHIO)ACETAMIDE
O=C(Nc1c(C)n(n(c1=O)c1ccccc1)C)CSc1nnc2c(n1)(nH)c1c2cccc1
ZINC000008854714
ZINC08854714
ZINC8854714

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Available files

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