Vitas-M small molecule compound
methyl 5-{[4-(4-chloro-2-methylphenoxy)butanoyl]amino}-4-cyano-3-methylthiophene-2-carboxylate
Catalog ID
STK418815
SMILES COC(=O)c1sc(c(c1C)C#N)NC(=O)CCCOc1ccc(cc1C)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 C19H19ClN2O4S MW 406.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19ClN2O4S/c1-11-9-13(20)6-7-15(11)26-8-4-5-16(23)22-18-14(10-21)12(2)17(27-18)19(24)25-3/h6-7,9H,4-5,8H2,1-3H3,(H,22,23)InChIKey
PIYXVIXPBVJYRU-UHFFFAOYSA-NSynonyms
CC1=C(C=CC(=C1)Cl)OCCCC(=O)NC2=C(C(=C(S2)C(=O)OC)C)C#N
InChI=1SC19H19ClN2O4Sc111913(20)6715(11)2684516(23)221814(1021)12(2)17(2718)19(24)253h679H458H213H3(H2223)
methyl5((4(4chloro2methylphenoxy)butanoyl)amino)4cyano3methylthiophene2carboxylate
METHYL5(4(4CHLORO2METHYLPHENOXY)BUTANOYLAMINO)4CYANO3METHYLTHIOPHENE2CARBOXYLATE
MFCD01348927
ZINC000002738562
ZINC02738562
ZINC2738562
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