Vitas-M small molecule compound
ethyl 2-{[(4-methoxyphenyl)carbamothioyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STK993854
SMILES CCOC(=O)c1c(NC(=S)Nc2ccc(cc2)OC)sc2c1CCCCC2
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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 C20H24N2O3S2 MW 404.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N2O3S2/c1-3-25-19(23)17-15-7-5-4-6-8-16(15)27-18(17)22-20(26)21-13-9-11-14(24-2)12-10-13/h9-12H,3-8H2,1-2H3,(H2,21,22,26)InChIKey
ZTKSVPYTXQOQJZ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCCC2)NC(=S)NC3=CC=C(C=C3)OC
ethyl2(((4methoxyphenyl)carbamothioyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
ethyl2((4methoxyphenyl)carbamothioylamino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
InChI=1SC20H24N2O3S2c132519(23)17157546816(15)2718(17)2220(26)211391114(242)121013h912H38H212H3(H2212226)
MFCD02053061
ZINC000005092027
ZINC05092027
ZINC5092027
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.