Vitas-M small molecule compound
methyl 2-({[(4-chloro-1-ethyl-1H-pyrazol-5-yl)carbonyl]carbamothioyl}amino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Catalog ID
STK775504
SMILES CCn1ncc(c1C(=O)NC(=S)Nc1sc2c(c1C(=O)OC)CCCCCC2)Cl
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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 C19H23ClN4O3S2 MW 455.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23ClN4O3S2/c1-3-24-15(12(20)10-21-24)16(25)22-19(28)23-17-14(18(26)27-2)11-8-6-4-5-7-9-13(11)29-17/h10H,3-9H2,1-2H3,(H2,22,23,25,28)InChIKey
XRTKAEZABIQYDX-UHFFFAOYSA-NSynonyms
956785-34-5956785345
CCN1C(=C(C=N1)Cl)C(=O)NC(=S)NC2=C(C3=C(S2)CCCCCC3)C(=O)OC
InChI=1SC19H23ClN4O3S2c132415(12(20)102124)16(25)2219(28)231714(18(26)272)1186457913(11)2917h10H39H212H3(H222232528)
methyl2((((4chloro1ethyl1Hpyrazol5yl)carbonyl)carbamothioyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
methyl2((4chloro2ethylpyrazole3carbonyl)carbamothioylamino)456789hexahydrocycloocta(b)thiophene3carboxylate
methyl2(3(4chloro1ethyl1Hpyrazole5carbonyl)thioureido)456789hexahydrocycloocta(b)thiophene3carboxylate
MFCD05257454
ZINC000009498715
ZINC09498715
ZINC9498715
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