Vitas-M small molecule compound
ethyl 2-({[(4-chlorophenyl)carbonyl]carbamothioyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK031713
SMILES CCOC(=O)c1c(NC(=S)NC(=O)c2ccc(cc2)Cl)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 C19H19ClN2O3S2 MW 422.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19ClN2O3S2/c1-2-25-18(24)15-13-5-3-4-6-14(13)27-17(15)22-19(26)21-16(23)11-7-9-12(20)10-8-11/h7-10H,2-6H2,1H3,(H2,21,22,23,26)InChIKey
AFDBVLARFYPXCL-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=S)NC(=O)C3=CC=C(C=C3)Cl
CCOC(=O)c1c(NC(=S)NC(=O)c2ccc(cc2)Cl)sc2c1CCCC2
ethyl2((((4chlorophenyl)carbonyl)carbamothioyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((4chlorobenzoyl)carbamothioylamino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC19H19ClN2O3S2c122518(24)1513534614(13)2717(15)2219(26)2116(23)117912(20)10811h710H26H21H3(H221222326)
MFCD01963180
STK031713
ZINC000002982357
ZINC02982357
ZINC2982357
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