Vitas-M small molecule compound
ethyl 2-({[2-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonyl)hydrazinyl]carbonothioyl}amino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Catalog ID
STK438522
SMILES CCOC(=O)c1c(NC(=S)NNC(=O)c2csc3c2CCCC3)sc2c1CCCCCC2
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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 C23H29N3O3S3 MW 491.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N3O3S3/c1-2-29-22(28)19-15-10-5-3-4-6-12-18(15)32-21(19)24-23(30)26-25-20(27)16-13-31-17-11-8-7-9-14(16)17/h13H,2-12H2,1H3,(H,25,27)(H2,24,26,30)InChIKey
BTBFTAAETNELLE-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCCCC2)NC(=S)NNC(=O)C3=CSC4=C3CCCC4
ethyl2(((2(4567tetrahydro1benzothiophen3ylcarbonyl)hydrazinyl)carbonothioyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
ethyl2((4567tetrahydro1benzothiophene3carbonylamino)carbamothioylamino)456789hexahydrocycloocta(b)thiophene3carboxylate
InChI=1SC23H29N3O3S3c122922(28)19151053461218(15)3221(19)2423(30)262520(27)161331171187914(16)17h13H212H21H3(H2527)(H2242630)
MFCD03945484
ZINC000020168508
ZINC20168508
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