Vitas-M small molecule compound
N-[(2Z)-4-ethyl-5-methyl-1,3-thiazol-2(3H)-ylidene]-2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetamide
Catalog ID
STL161437
SMILES CCc1[nH]/c(=N/C(=O)Cn2nc3CCCCCc3cc2=O)/sc1C
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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 C17H22N4O2S MW 346.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N4O2S/c1-3-13-11(2)24-17(18-13)19-15(22)10-21-16(23)9-12-7-5-4-6-8-14(12)20-21/h9H,3-8,10H2,1-2H3,(H,18,19,22)InChIKey
BTOIHMCDOLSJEW-UHFFFAOYSA-NSynonyms
1282120-37-91282120379
CCc1(nH)c(=NC(=O)Cn2nc3CCCCCc3cc2=O)sc1C
CCC1=C(SC(=N1)NC(=O)CN2C(=O)C=C3CCCCCC3=N2)C
InChI=1SC17H22N4O2Sc131311(2)2417(1813)1915(22)102116(23)9127546814(12)2021h9H3810H212H3(H181922)
MFCD20759378
N((2Z)4ethyl5methyl13thiazol2(3H)ylidene)2(3oxo356789hexahydro2Hcyclohepta(c)pyridazin2yl)acetamide
N(4ethyl5methyl13thiazol2yl)2(3oxo6789tetrahydro5Hcyclohepta(c)pyridazin2yl)acetamide
ZINC000061720651
ZINC61720651
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