Vitas-M small molecule compound

N-[5,7-bis(4-chlorophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-4-chloro-3-nitrobenzamide

Catalog ID
STL338501
SMILES Clc1ccc(cc1)C1C=C(Nc2n1nc(n2)NC(=O)c1ccc(c(c1)[N+](=O)[O-])Cl)c1ccc(cc1)Cl

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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 C24H15Cl3N6O3 MW 541.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H15Cl3N6O3/c25-16-6-1-13(2-7-16)19-12-20(14-3-8-17(26)9-4-14)32-24(28-19)30-23(31-32)29-22(34)15-5-10-18(27)21(11-15)33(35)36/h1-12,20H,(H2,28,29,30,31,34)
InChIKey
CSPJAMSRUOFNTP-UHFFFAOYSA-N
Synonyms

C1=CC(=CC=C1C2C=C(N=C3N2NC(=N3)NC(=O)C4=CC(=C(C=C4)Cl)(N+)(=O)(O))C5=CC=C(C=C5)Cl)Cl
Clc1ccc(cc1)C1C=C(Nc2n1nc(n2)NC(=O)c1ccc(c(c1)(N+)(=O)(O))Cl)c1ccc(cc1)Cl
Clc1ccc(cc1)C1C=C(Nc2n1nc(n2)NC(=O)c1ccc(c(c1)(N+)(=O)(O))Cl)c1ccc(cc1)ClCl
InChI=1SC24H15Cl3N6O3c25166113(2716)191220(143817(26)9414)3224(2819)3023(3132)2922(34)1551018(27)21(1115)33(35)36h11220H(H22829303134)
MFCD03692627
N(57BIS(4CHLOROPHENYL)17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDIN2YL)4CHLORO3NITROBENZAMIDE
N(57bis(4chlorophenyl)47dihydro(124)triazolo(15a)pyrimidin2yl)4chloro3nitrobenzamide
N(57bis(4chlorophenyl)47dihydro(124)triazolo(15a)pyrimidin2yl)4chloro3nitrobenzamidehydrochloride
ZINC000002254261
ZINC000002254262

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Available files

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