Vitas-M small molecule compound
({(2E)-2-[2-(1,3-benzodioxol-5-ylcarbonyl)hydrazinylidene]-2-phenylethyl}sulfanyl)acetic acid
Catalog ID
STK331380
SMILES OC(=O)CSC/C(=N/NC(=O)c1ccc2c(c1)OCO2)/c1ccccc1
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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 C18H16N2O5S MW 372.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O5S/c21-17(22)10-26-9-14(12-4-2-1-3-5-12)19-20-18(23)13-6-7-15-16(8-13)25-11-24-15/h1-8H,9-11H2,(H,20,23)(H,21,22)/b19-14-InChIKey
IVDLAOSUHVEXJO-RGEXLXHISA-NSynonyms
(((2E)2(2(13benzodioxol5ylcarbonyl)hydrazinylidene)2phenylethyl)sulfanyl)aceticacid
2((2E)2(13benzodioxole5carbonylhydrazinylidene)2phenylethyl)sulfanylaceticacid
C1OC2=C(O1)C=C(C=C2)C(=O)NN=C(CSCC(=O)O)C3=CC=CC=C3
InChI=1SC18H16N2O5Sc2117(22)1026914(124213512)192018(23)13671516(813)25112415h18H911H2(H2023)(H2122)b1914
MFCD09962538
OC(=O)CSCC(=NNC(=O)c1ccc2c(c1)OCO2)c1ccccc1
ZINC000018194399
ZINC97499305
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