Vitas-M small molecule compound
N-(4-chlorophenyl)-2-[5-(2,6-dimethylphenyl)-4,6-dioxo-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl]acetamide
Catalog ID
STK305773
SMILES O=C(Nc1ccc(cc1)Cl)CN1N=NC2C1C(=O)N(C2=O)c1c(C)cccc1C
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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 C20H18ClN5O3 MW 411.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClN5O3/c1-11-4-3-5-12(2)17(11)26-19(28)16-18(20(26)29)25(24-23-16)10-15(27)22-14-8-6-13(21)7-9-14/h3-9,16,18H,10H2,1-2H3,(H,22,27)InChIKey
UOZWAWODDXTRNP-UHFFFAOYSA-NSynonyms
1024304-18-41024304184
CC1=C(C(=CC=C1)C)N2C(=O)C3C(C2=O)N(N=N3)CC(=O)NC4=CC=C(C=C4)Cl
InChI=1SC20H18ClN5O3c11143512(2)17(11)2619(28)1618(20(26)29)25(242316)1015(27)22148613(21)7914h391618H10H212H3(H2227)
MFCD04045550
N(4CHLOROPHENYL)2(5(26DIMETHYLPHENYL)46DIOXO3A6ADIHYDROPYRROLO(34D)TRIAZOL3YL)ACETAMIDE
N(4chlorophenyl)2(5(26dimethylphenyl)46dioxo4566atetrahydropyrrolo(34d)(123)triazol1(3aH)yl)acetamide
ZINC000002787589
ZINC000102002061
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