Vitas-M small molecule compound
N-[(2E)-5-cyclopropyl-1,3,4-thiadiazol-2(3H)-ylidene]-2-[3-(2-fluoro-4-methoxyphenyl)-6-oxopyridazin-1(6H)-yl]acetamide
Catalog ID
STL159744
SMILES COc1ccc(c(c1)F)c1ccc(=O)n(n1)CC(=O)/N=c/1\[nH]nc(s1)C1CC1
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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 C18H16FN5O3S MW 401.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16FN5O3S/c1-27-11-4-5-12(13(19)8-11)14-6-7-16(26)24(23-14)9-15(25)20-18-22-21-17(28-18)10-2-3-10/h4-8,10H,2-3,9H2,1H3,(H,20,22,25)InChIKey
OPZBCDQALJMDMY-UHFFFAOYSA-NSynonyms
1246052-01-61246052016
COC1=CC(=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)NC3=NN=C(S3)C4CC4)F
COc1ccc(c(c1)F)c1ccc(=O)n(n1)CC(=O)N=c1(nH)nc(s1)C1CC1
InChI=1SC18H16FN5O3Sc127114512(13(19)811)146716(26)24(2314)915(25)2018222117(2818)102310h4810H239H21H3(H202225)
MFCD20758788
N((2E)5cyclopropyl134thiadiazol2(3H)ylidene)2(3(2fluoro4methoxyphenyl)6oxopyridazin1(6H)yl)acetamide
N(5cyclopropyl134thiadiazol2yl)2(3(2fluoro4methoxyphenyl)6oxopyridazin1yl)acetamide
ZINC000049551039
ZINC49551039
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