Vitas-M small molecule compound
methyl 2-({[2-(1,3-benzodioxol-5-ylcarbonyl)hydrazinyl]carbonothioyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK437127
SMILES COC(=O)c1c(NC(=S)NNC(=O)c2ccc3c(c2)OCO3)sc2c1CCCC2
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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 C19H19N3O5S2 MW 433.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O5S2/c1-25-18(24)15-11-4-2-3-5-14(11)29-17(15)20-19(28)22-21-16(23)10-6-7-12-13(8-10)27-9-26-12/h6-8H,2-5,9H2,1H3,(H,21,23)(H2,20,22,28)InChIKey
AWYLUGYQEYKBAA-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(SC2=C1CCCC2)NC(=S)NNC(=O)C3=CC4=C(C=C3)OCO4
InChI=1SC19H19N3O5S2c12518(24)1511423514(11)2917(15)2019(28)222116(23)10671213(810)2792612h68H259H21H3(H2123)(H2202228)
methyl2(((2(13benzodioxol5ylcarbonyl)hydrazinyl)carbonothioyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((13benzodioxole5carbonylamino)carbamothioylamino)4567tetrahydro1benzothiophene3carboxylate
MFCD03944639
ZINC000017098451
ZINC17098451
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