Vitas-M small molecule compound
N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(2-methylpropyl)-2-{3-[4-(methylsulfanyl)phenyl]-6-oxopyridazin-1(6H)-yl}acetamide
Catalog ID
STK939023
SMILES CSc1ccc(cc1)c1ccc(=O)n(n1)CC(=O)N(C1CCS(=O)(=O)C1)CC(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 C21H27N3O4S2 MW 449.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O4S2/c1-15(2)12-23(17-10-11-30(27,28)14-17)21(26)13-24-20(25)9-8-19(22-24)16-4-6-18(29-3)7-5-16/h4-9,15,17H,10-14H2,1-3H3InChIKey
YMKSFRVDZGYQTC-UHFFFAOYSA-NSynonyms
1232770-79-41232770794
CC(C)CN(C1CCS(=O)(=O)C1)C(=O)CN2C(=O)C=CC(=N2)C3=CC=C(C=C3)SC
InChI=1SC21H27N3O4S2c115(2)1223(17101130(2728)1417)21(26)132420(25)9819(2224)164618(293)7516h491517H1014H213H3
MFCD18066101
N(11dioxidotetrahydrothiophen3yl)N(2methylpropyl)2(3(4(methylsulfanyl)phenyl)6oxopyridazin1(6H)yl)acetamide
N(11dioxidotetrahydrothiophen3yl)Nisobutyl2(3(4(methylthio)phenyl)6oxopyridazin1(6H)yl)acetamide
N(11dioxothiolan3yl)N(2methylpropyl)2(3(4methylsulfanylphenyl)6oxopyridazin1yl)acetamide
ZINC000044916657
ZINC000044916662
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