Vitas-M small molecule compound

N-(5-chloro-2-methylphenyl)-2-[5-(3-chlorophenyl)-4,6-dioxo-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl]acetamide

Catalog ID
STL094809
SMILES O=C(CN1N=NC2C1C(=O)N(C2=O)c1cccc(c1)Cl)Nc1cc(Cl)ccc1C

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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 C19H15Cl2N5O3 MW 432.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15Cl2N5O3/c1-10-5-6-12(21)8-14(10)22-15(27)9-25-17-16(23-24-25)18(28)26(19(17)29)13-4-2-3-11(20)7-13/h2-8,16-17H,9H2,1H3,(H,22,27)
InChIKey
TZVMUUMAPJGCNX-UHFFFAOYSA-N
Synonyms

CC1=C(C=C(C=C1)Cl)NC(=O)CN2C3C(C(=O)N(C3=O)C4=CC(=CC=C4)Cl)N=N2
InChI=1SC19H15Cl2N5O3c1105612(21)814(10)2215(27)9251716(232425)18(28)26(19(17)29)1342311(20)713h281617H9H21H3(H2227)
MFCD14757208
N(5chloro2methylphenyl)2(5(3chlorophenyl)46dioxo3a6adihydropyrrolo(34d)triazol3yl)acetamide
N(5chloro2methylphenyl)2(5(3chlorophenyl)46dioxo4566atetrahydropyrrolo(34d)(123)triazol1(3aH)yl)acetamide
ZINC000009835847
ZINC000101416330

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Available files

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