Vitas-M small molecule compound
ethyl 2-{[(4-methoxyphenyl)carbamothioyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK829945
SMILES CCOC(=O)c1c(NC(=S)Nc2ccc(cc2)OC)sc2c1CCC(C2)C
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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/c1-4-25-19(23)17-15-10-5-12(2)11-16(15)27-18(17)22-20(26)21-13-6-8-14(24-3)9-7-13/h6-9,12H,4-5,10-11H2,1-3H3,(H2,21,22,26)InChIKey
PKLQCCKYPDXGGO-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=S)NC3=CC=C(C=C3)OC
ethyl2(((4methoxyphenyl)carbamothioyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
ethyl2((4methoxyphenyl)carbamothioylamino)6methyl4567tetrahydro1benzothiophene3carboxylate
ethyl2(3(4methoxyphenyl)thioureido)6methyl4567tetrahydrobenzo(b)thiophene3carboxylate
InChI=1SC20H24N2O3S2c142519(23)171510512(2)1116(15)2718(17)2220(26)21136814(243)9713h6912H451011H213H3(H2212226)
MFCD02239888
ZINC000000985935
ZINC000000985936
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