Vitas-M small molecule compound
methyl 2-({[(2-chlorophenyl)carbonyl]carbamothioyl}amino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Catalog ID
STK998029
SMILES COC(=O)c1c(NC(=S)NC(=O)c2ccccc2Cl)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 C20H21ClN2O3S2 MW 436.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21ClN2O3S2/c1-26-19(25)16-13-9-4-2-3-5-11-15(13)28-18(16)23-20(27)22-17(24)12-8-6-7-10-14(12)21/h6-8,10H,2-5,9,11H2,1H3,(H2,22,23,24,27)InChIKey
NLEZFKDGFGLRFT-UHFFFAOYSA-NSynonyms
500147-90-0500147900
COC(=O)C1=C(SC2=C1CCCCCC2)NC(=S)NC(=O)C3=CC=CC=C3Cl
InChI=1SC20H21ClN2O3S2c12619(25)1613942351115(13)2818(16)2320(27)2217(24)128671014(12)21h6810H25911H21H3(H222232427)
methyl2((((2chlorophenyl)carbonyl)carbamothioyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
methyl2((2chlorobenzoyl)carbamothioylamino)456789hexahydrocycloocta(b)thiophene3carboxylate
methyl2(3(2chlorobenzoyl)thioureido)456789hexahydrocycloocta(b)thiophene3carboxylate
MFCD03304726
ZINC000009496750
ZINC09496750
ZINC9496750
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