Vitas-M small molecule compound
ethyl [(2Z)-2-{[(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetyl]imino}-2,3-dihydro-1,3-thiazol-4-yl]acetate
Catalog ID
STL154028
SMILES CCOC(=O)Cc1cs/c(=N\C(=O)Cn2nc3CCCCCc3cc2=O)/[nH]1
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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 C18H22N4O4S MW 390.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N4O4S/c1-2-26-17(25)9-13-11-27-18(19-13)20-15(23)10-22-16(24)8-12-6-4-3-5-7-14(12)21-22/h8,11H,2-7,9-10H2,1H3,(H,19,20,23)InChIKey
MBNHANKRAGQOST-UHFFFAOYSA-NSynonyms
1282114-69-51282114695
CCOC(=O)CC1=CSC(=N1)NC(=O)CN2C(=O)C=C3CCCCCC3=N2
CCOC(=O)Cc1csc(=NC(=O)Cn2nc3CCCCCc3cc2=O)(nH)1
ethyl((2Z)2(((3oxo356789hexahydro2Hcyclohepta(c)pyridazin2yl)acetyl)imino)23dihydro13thiazol4yl)acetate
ethyl2(2((2(3oxo6789tetrahydro5Hcyclohepta(c)pyridazin2yl)acetyl)amino)13thiazol4yl)acetate
InChI=1SC18H22N4O4Sc122617(25)913112718(1913)2015(23)102216(24)8126435714(12)2122h811H27910H21H3(H192023)
MFCD20756859
ZINC000061720026
ZINC61720026
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