Vitas-M small molecule compound
methyl 2-{[(4-chlorophenyl)carbonyl]amino}-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,3,3-trifluoroalaninate
Catalog ID
STL327630
SMILES N#Cc1c(sc2c1CCCC2)NC(C(F)(F)F)(C(=O)OC)NC(=O)c1ccc(cc1)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 C20H17ClF3N3O3S MW 471.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClF3N3O3S/c1-30-18(29)19(20(22,23)24,26-16(28)11-6-8-12(21)9-7-11)27-17-14(10-25)13-4-2-3-5-15(13)31-17/h6-9,27H,2-5H2,1H3,(H,26,28)InChIKey
NZUYQFLYUAMMEW-UHFFFAOYSA-NSynonyms
352317-69-2352317692
COC(=O)C(C(F)(F)F)(NC1=C(C2=C(S1)CCCC2)C#N)NC(=O)C3=CC=C(C=C3)Cl
InChI=1SC20H17ClF3N3O3Sc13018(29)19(20(2223)242616(28)116812(21)9711)271714(1025)13423515(13)3117h6927H25H21H3(H2628)
methyl2(((4chlorophenyl)carbonyl)amino)N(3cyano4567tetrahydro1benzothiophen2yl)333trifluoroalaninate
methyl2((4chlorobenzoyl)amino)2((3cyano4567tetrahydro1benzothiophen2yl)amino)333trifluoropropanoate
methyl2(4chlorobenzamido)2((3cyano4567tetrahydrobenzo(b)thiophen2yl)amino)333trifluoropropanoate
MFCD01949537
ZINC000002050149
ZINC000002050150
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