Vitas-M small molecule compound
methyl 4-cyano-3-methyl-5-{[(4-nitrophenoxy)acetyl]amino}thiophene-2-carboxylate
Catalog ID
STK120044
SMILES COC(=O)c1sc(c(c1C)C#N)NC(=O)COc1ccc(cc1)[N+](=O)[O-]
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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 C16H13N3O6S MW 375.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N3O6S/c1-9-12(7-17)15(26-14(9)16(21)24-2)18-13(20)8-25-11-5-3-10(4-6-11)19(22)23/h3-6H,8H2,1-2H3,(H,18,20)InChIKey
TTYOGGQGDOYRHG-UHFFFAOYSA-NSynonyms
CC1=C(SC(=C1C#N)NC(=O)COC2=CC=C(C=C2)(N+)(=O)(O))C(=O)OC
COC(=O)c1sc(c(c1C)C#N)NC(=O)COc1ccc(cc1)(N+)(=O)(O)
InChI=1SC16H13N3O6Sc1912(717)15(2614(9)16(21)242)1813(20)825115310(4611)19(22)23h36H8H212H3(H1820)
METHYL4CYANO3METHYL5(((4NITROPHENOXY)ACETYL)AMINO)THIOPHENE2CARBOXYLATE
METHYL4CYANO3METHYL5((2(4NITROPHENOXY)ACETYL)AMINO)THIOPHENE2CARBOXYLATE
METHYL4CYANO3METHYL5(2(4NITROPHENOXY)ACETYLAMINO)THIOPHENE2CARBOXYLATE
MFCD03242994
ZINC000004691529
ZINC04691529
ZINC4691529
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