Vitas-M small molecule compound
1-(1,1-dioxidotetrahydrothiophen-3-yl)-N-[(2E)-5-(methylsulfanyl)-1,3,4-thiadiazol-2(3H)-ylidene]-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
Catalog ID
STK627661
SMILES CSc1n[nH]/c(=N\C(=O)c2nn(c3c2CCCC3)C2CCS(=O)(=O)C2)/s1
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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 C15H19N5O3S3 MW 413.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H19N5O3S3/c1-24-15-18-17-14(25-15)16-13(21)12-10-4-2-3-5-11(10)20(19-12)9-6-7-26(22,23)8-9/h9H,2-8H2,1H3,(H,16,17,21)InChIKey
FNAOKSQSIHGFHA-UHFFFAOYSA-NSynonyms
942814-11-11(11dioxidotetrahydrothiophen3yl)N((2E)5(methylsulfanyl)134thiadiazol2(3H)ylidene)4567tetrahydro1Hindazole3carboxamide
1(11dioxothiolan3yl)N(5methylsulfanyl134thiadiazol2yl)4567tetrahydroindazole3carboxamide
942814111
CSC1=NN=C(S1)NC(=O)C2=NN(C3=C2CCCC3)C4CCS(=O)(=O)C4
CSc1n(nH)c(=NC(=O)c2nn(c3c2CCCC3)C2CCS(=O)(=O)C2)s1
InChI=1SC15H19N5O3S3c12415181714(2515)1613(21)1210423511(10)20(1912)96726(2223)89h9H28H21H3(H161721)
MFCD18159222
ZINC000013692687
ZINC000013692688
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