Vitas-M small molecule compound
ethyl 1-({4-chloro-3-[(5,5-dioxido-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-yl)amino]phenyl}carbonyl)piperidine-4-carboxylate
Catalog ID
STL131528
SMILES CCOC(=O)C1CCN(CC1)C(=O)c1ccc(c(c1)NC1=NC2C(S1)CS(=O)(=O)C2)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 C20H24ClN3O5S2 MW 486.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24ClN3O5S2/c1-2-29-19(26)12-5-7-24(8-6-12)18(25)13-3-4-14(21)15(9-13)22-20-23-16-10-31(27,28)11-17(16)30-20/h3-4,9,12,16-17H,2,5-8,10-11H2,1H3,(H,22,23)InChIKey
VGFIKAGLGYIDNO-UHFFFAOYSA-NSynonyms
CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=C(C=C2)Cl)NC3=NC4CS(=O)(=O)CC4S3
ethyl1((4chloro3((55dioxido3a466atetrahydrothieno(34d)(13)thiazol2yl)amino)phenyl)carbonyl)piperidine4carboxylate
ETHYL1(4CHLORO3((55DIOXIDO3A466ATETRAHYDROTHIENO(34D)(13)THIAZOL2YL)AMINO)BENZOYL)PIPERIDINE4CARBOXYLATE
ETHYL1(4CHLORO3((55DIOXO3A466ATETRAHYDROTHIENO(34D)(13)THIAZOL2YL)AMINO)BENZOYL)PIPERIDINE4CARBOXYLATE
InChI=1SC20H24ClN3O5S2c122919(26)125724(8612)18(25)133414(21)15(913)222023161031(2728)1117(16)3020h349121617H2581011H21H3(H2223)
MFCD15083857
ZINC000002959367
ZINC000006577934
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