Vitas-M small molecule compound

methyl 5-({[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]carbonyl}amino)-4-cyano-3-methylthiophene-2-carboxylate

Catalog ID
STK419229
SMILES COC(=O)c1sc(c(c1C)C#N)NC(=O)c1c(C)onc1c1ccccc1Cl

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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 C19H14ClN3O4S MW 415.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14ClN3O4S/c1-9-12(8-21)18(28-16(9)19(25)26-3)22-17(24)14-10(2)27-23-15(14)11-6-4-5-7-13(11)20/h4-7H,1-3H3,(H,22,24)
InChIKey
KVPRQYKENPORKB-UHFFFAOYSA-N
Synonyms
312952-11-7
312952117
CC1=C(SC(=C1C#N)NC(=O)C2=C(ON=C2C3=CC=CC=C3Cl)C)C(=O)OC
InChI=1SC19H14ClN3O4Sc1912(821)18(2816(9)19(25)263)2217(24)1410(2)272315(14)11645713(11)20h47H13H3(H2224)
methyl5(((3(2chlorophenyl)5methyl12oxazol4yl)carbonyl)amino)4cyano3methylthiophene2carboxylate
METHYL5(((3(2CHLOROPHENYL)5METHYL4ISOXAZOLYL)CARBONYL)AMINO)4CYANO3METHYL2THIOPHENECARBOXYLATE
METHYL5((3(2CHLOROPHENYL)5METHYL12OXAZOLE4CARBONYL)AMINO)4CYANO3METHYLTHIOPHENE2CARBOXYLATE
METHYL5(3(2CHLOROPHENYL)5METHYL12OXAZOLE4AMIDO)4CYANO3METHYLTHIOPHENE2CARBOXYLATE
MFCD01357309
ZINC000000997427
ZINC00997427
ZINC997427

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.