Vitas-M small molecule compound
N-[(2E)-5-cyclohexyl-1,3,4-thiadiazol-2(3H)-ylidene]-2-[3-(3,4-dimethoxyphenyl)-6-oxopyridazin-1(6H)-yl]acetamide
Catalog ID
STL160263
SMILES COc1cc(ccc1OC)c1ccc(=O)n(n1)CC(=O)/N=c/1\[nH]nc(s1)C1CCCCC1
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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 C22H25N5O4S MW 455.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N5O4S/c1-30-17-10-8-15(12-18(17)31-2)16-9-11-20(29)27(26-16)13-19(28)23-22-25-24-21(32-22)14-6-4-3-5-7-14/h8-12,14H,3-7,13H2,1-2H3,(H,23,25,28)InChIKey
HZISRYQGOHXDDV-UHFFFAOYSA-NSynonyms
1282123-93-61282123936
COC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)NC3=NN=C(S3)C4CCCCC4)OC
COc1cc(ccc1OC)c1ccc(=O)n(n1)CC(=O)N=c1(nH)nc(s1)C1CCCCC1
InChI=1SC22H25N5O4Sc1301710815(1218(17)312)1691120(29)27(2616)1319(28)2322252421(3222)146435714h81214H3713H212H3(H232528)
MFCD20758960
N((2E)5cyclohexyl134thiadiazol2(3H)ylidene)2(3(34dimethoxyphenyl)6oxopyridazin1(6H)yl)acetamide
N(5cyclohexyl134thiadiazol2yl)2(3(34dimethoxyphenyl)6oxopyridazin1yl)acetamide
ZINC000061720648
ZINC61720648
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