Vitas-M small molecule compound
4-[bis(cyanomethyl)carbamoyl]phenyl acetate
Catalog ID
STK049429
SMILES N#CCN(C(=O)c1ccc(cc1)OC(=O)C)CC#N
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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 C13H11N3O3 MW 257.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11N3O3/c1-10(17)19-12-4-2-11(3-5-12)13(18)16(8-6-14)9-7-15/h2-5H,8-9H2,1H3InChIKey
PSKHAGIPWDLDHW-UHFFFAOYSA-NSynonyms
329930-56-5(4(BIS(CYANOMETHYL)CARBAMOYL)PHENYL)ACETATE
329930565
4(BIS(CYANOMETHYL)CARBAMOYL)PHENYLACETATE
4(NNBIS(CYANOMETHYL)CARBAMOYL)PHENYLACETATE
CC(=O)OC1=CC=C(C=C1)C(=O)N(CC#N)CC#N
InChI=1SC13H11N3O3c110(17)19124211(3512)13(18)16(8614)9715h25H89H21H3
MFCD01195179
N#CCN(C(=O)c1ccc(cc1)OC(=O)C)CC#N
STK049429
ZINC000000060656
ZINC00060656
ZINC60656
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