Vitas-M small molecule compound
N'-[(E)-(6-chloro-1,3-benzodioxol-5-yl)methylidene]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]acetohydrazide
Catalog ID
STL294842
SMILES O=C(CSc1nnnn1c1ccccc1)N/N=C/c1cc2OCOc2cc1Cl
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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 C17H13ClN6O3S MW 416.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13ClN6O3S/c18-13-7-15-14(26-10-27-15)6-11(13)8-19-20-16(25)9-28-17-21-22-23-24(17)12-4-2-1-3-5-12/h1-8H,9-10H2,(H,20,25)/b19-8+InChIKey
OJFOTKCFONYNRO-UFWORHAWSA-NSynonyms
C1OC2=C(O1)C=C(C(=C2)C=NNC(=O)CSC3=NN=NN3C4=CC=CC=C4)Cl
InChI=1SC17H13ClN6O3Sc181371514(26102715)611(13)8192016(25)9281721222324(17)124213512h18H910H2(H2025)b198+
MFCD01160817
N((E)(6chloro13benzodioxol5yl)methylidene)2((1phenyl1Htetrazol5yl)sulfanyl)acetohydrazide
N((E)(6chloro13benzodioxol5yl)methylideneamino)2(1phenyltetrazol5yl)sulfanylacetamide
O=C(CSc1nnnn1c1ccccc1)NN=Cc1cc2OCOc2cc1Cl
ZINC000027500037
ZINC103358020
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