Vitas-M small molecule compound
methyl 4-cyano-3-methyl-5-[(2-phenoxybutanoyl)amino]thiophene-2-carboxylate
Catalog ID
STK425071
SMILES CCC(C(=O)Nc1sc(c(c1C#N)C)C(=O)OC)Oc1ccccc1
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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 C18H18N2O4S MW 358.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O4S/c1-4-14(24-12-8-6-5-7-9-12)16(21)20-17-13(10-19)11(2)15(25-17)18(22)23-3/h5-9,14H,4H2,1-3H3,(H,20,21)InChIKey
AAOMQWIZPPDYQI-UHFFFAOYSA-NSynonyms
438455-20-0438455200
CCC(C(=O)NC1=C(C(=C(S1)C(=O)OC)C)C#N)OC2=CC=CC=C2
InChI=1SC18H18N2O4Sc1414(24128657912)16(21)201713(1019)11(2)15(2517)18(22)233h5914H4H213H3(H2021)
methyl4cyano3methyl5((2phenoxybutanoyl)amino)thiophene2carboxylate
METHYL4CYANO3METHYL5(2PHENOXYBUTANOYLAMINO)THIOPHENE2CARBOXYLATE
MFCD01921335
ZINC000002748111
ZINC000002748112
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