Vitas-M small molecule compound
8-oxo-N-{4-[(tetrahydrofuran-2-ylmethyl)carbamoyl]-1,2,3-thiadiazol-5-yl}-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Catalog ID
STL441789
SMILES O=C(N1CC2CC(C1)c1n(C2)c(=O)ccc1)Nc1snnc1C(=O)NCC1CCCO1
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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 C20H24N6O4S MW 444.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N6O4S/c27-16-5-1-4-15-13-7-12(10-26(15)16)9-25(11-13)20(29)22-19-17(23-24-31-19)18(28)21-8-14-3-2-6-30-14/h1,4-5,12-14H,2-3,6-11H2,(H,21,28)(H,22,29)InChIKey
HGZQHCFOWDSHNS-UHFFFAOYSA-NSynonyms
8oxoN(4((tetrahydrofuran2ylmethyl)carbamoyl)123thiadiazol5yl)1568tetrahydro2H15methanopyrido(12a)(15)diazocine3(4H)carboxamide
C1CC(OC1)CNC(=O)C2=C(SN=N2)NC(=O)N3CC4CC(C3)C5=CC=CC(=O)N5C4
InChI=1SC20H24N6O4Sc27165141513712(1026(15)16)925(1113)20(29)221917(23243119)18(28)218143263014h1451214H23611H2(H2128)(H2229)
MFCD11840947
ZINC000033435742
ZINC000033435743
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