Vitas-M small molecule compound
propan-2-yl {3-[4-(methylsulfanyl)phenyl]-6-oxopyridazin-1(6H)-yl}acetate
Catalog ID
STK940617
SMILES CSc1ccc(cc1)c1ccc(=O)n(n1)CC(=O)OC(C)C
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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 C16H18N2O3S MW 318.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N2O3S/c1-11(2)21-16(20)10-18-15(19)9-8-14(17-18)12-4-6-13(22-3)7-5-12/h4-9,11H,10H2,1-3H3InChIKey
JMWIBHWDQSDHFJ-UHFFFAOYSA-NSynonyms
1232790-98-51232790985
CC(C)OC(=O)CN1C(=O)C=CC(=N1)C2=CC=C(C=C2)SC
InChI=1SC16H18N2O3Sc111(2)2116(20)101815(19)9814(1718)124613(223)7512h4911H10H213H3
isopropyl2(3(4(methylthio)phenyl)6oxopyridazin1(6H)yl)acetate
MFCD18065479
propan2yl(3(4(methylsulfanyl)phenyl)6oxopyridazin1(6H)yl)acetate
propan2yl2(3(4methylsulfanylphenyl)6oxopyridazin1yl)acetate
ZINC000044919187
ZINC44919187
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