Vitas-M small molecule compound
methyl 2-[(2,2,2-trichloro-1-{[(2-methylphenyl)carbonyl]amino}ethyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK809279
SMILES COC(=O)c1c(sc2c1CCCC2)NC(C(Cl)(Cl)Cl)NC(=O)c1ccccc1C
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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 C20H21Cl3N2O3S MW 475.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21Cl3N2O3S/c1-11-7-3-4-8-12(11)16(26)24-19(20(21,22)23)25-17-15(18(27)28-2)13-9-5-6-10-14(13)29-17/h3-4,7-8,19,25H,5-6,9-10H2,1-2H3,(H,24,26)InChIKey
RDGWXUIOSBJVDR-UHFFFAOYSA-NSynonyms
CC1=CC=CC=C1C(=O)NC(C(Cl)(Cl)Cl)NC2=C(C3=C(S2)CCCC3)C(=O)OC
InChI=1SC20H21Cl3N2O3Sc111734812(11)16(26)2419(20(2122)23)251715(18(27)282)139561014(13)2917h34781925H56910H212H3(H2426)
methyl2((222trichloro1(((2methylphenyl)carbonyl)amino)ethyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((222trichloro1((2methylbenzoyl)amino)ethyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD00615987
ZINC000002678281
ZINC000002678282
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