Vitas-M small molecule compound
(2E)-2-(1,3-benzodioxol-5-ylmethylidene)-N-(3-methylphenyl)hydrazinecarbothioamide
Catalog ID
STK024795
SMILES S=C(Nc1cccc(c1)C)N/N=C/c1ccc2c(c1)OCO2
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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 C16H15N3O2S MW 313.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N3O2S/c1-11-3-2-4-13(7-11)18-16(22)19-17-9-12-5-6-14-15(8-12)21-10-20-14/h2-9H,10H2,1H3,(H2,18,19,22)/b17-9+InChIKey
WHXVLLXWJCZVGM-RQZCQDPDSA-NSynonyms
7762-93-8(2E)2(13BENZODIOXOL5YLMETHYLIDENE)N(3METHYLPHENYL)HYDRAZINECARBOTHIOAMIDE
1((E)13BENZODIOXOL5YLMETHYLIDENEAMINO)3(3METHYLPHENYL)THIOUREA
13BENZODIOXOLE5CARBALDEHYDEN(3METHYLPHENYL)THIOSEMICARBAZONE
7762938
CC1=CC(=CC=C1)NC(=S)NN=CC2=CC3=C(C=C2)OCO3
InChI=1SC16H15N3O2Sc11132413(711)1816(22)1917912561415(812)21102014h29H10H21H3(H2181922)b179+
MFCD01439082
S=C(Nc1cccc(c1)C)NN=Cc1ccc2c(c1)OCO2
STK024795
ZINC000008685051
ZINC33307910
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