Vitas-M small molecule compound
methyl 2-[(2,2,2-trichloro-1-{[(4-methoxyphenyl)carbonyl]amino}ethyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK726711
SMILES COc1ccc(cc1)C(=O)NC(C(Cl)(Cl)Cl)Nc1sc2c(c1C(=O)OC)CCCC2
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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 C20H21Cl3N2O4S MW 491.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21Cl3N2O4S/c1-28-12-9-7-11(8-10-12)16(26)24-19(20(21,22)23)25-17-15(18(27)29-2)13-5-3-4-6-14(13)30-17/h7-10,19,25H,3-6H2,1-2H3,(H,24,26)InChIKey
UWYCZMZDYGSZJM-UHFFFAOYSA-NSynonyms
324073-54-3324073543
COC1=CC=C(C=C1)C(=O)NC(C(Cl)(Cl)Cl)NC2=C(C3=C(S2)CCCC3)C(=O)OC
InChI=1SC20H21Cl3N2O4Sc128129711(81012)16(26)2419(20(2122)23)251715(18(27)292)13534614(13)3017h7101925H36H212H3(H2426)
methyl2((222trichloro1(((4methoxyphenyl)carbonyl)amino)ethyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((222trichloro1((4methoxybenzoyl)amino)ethyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((222trichloro1(4methoxybenzamido)ethyl)amino)4567tetrahydrobenzo(b)thiophene3carboxylate
MFCD00615989
ZINC000002272487
ZINC000002272488
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