Vitas-M small molecule compound
N-(5-chloro-2-methylphenyl)-2-[5-(3-chloro-4-methylphenyl)-4,6-dioxo-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl]acetamide
Catalog ID
STL193026
SMILES O=C(Nc1cc(Cl)ccc1C)CN1N=NC2C1C(=O)N(C2=O)c1ccc(c(c1)Cl)C
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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 C20H17Cl2N5O3 MW 446.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17Cl2N5O3/c1-10-4-6-13(8-14(10)22)27-19(29)17-18(20(27)30)26(25-24-17)9-16(28)23-15-7-12(21)5-3-11(15)2/h3-8,17-18H,9H2,1-2H3,(H,23,28)InChIKey
SRXLHPSHQYARGK-UHFFFAOYSA-NSynonyms
1052560-46-91052560469
CC1=C(C=C(C=C1)Cl)NC(=O)CN2C3C(C(=O)N(C3=O)C4=CC(=C(C=C4)C)Cl)N=N2
InChI=1SC20H17Cl2N5O3c1104613(814(10)22)2719(29)1718(20(27)30)26(252417)916(28)2315712(21)5311(15)2h381718H9H212H3(H2328)
MFCD07650260
N(5chloro2methylphenyl)2(5(3chloro4methylphenyl)46dioxo3a6adihydropyrrolo(34d)triazol3yl)acetamide
N(5chloro2methylphenyl)2(5(3chloro4methylphenyl)46dioxo4566atetrahydropyrrolo(34d)(123)triazol1(3aH)yl)acetamide
ZINC000009748481
ZINC000101083665
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