Vitas-M small molecule compound

methyl 4-{[(Z)-(5-cyano-1,4-dimethyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene)methyl]amino}benzoate

Catalog ID
STL170976
SMILES COC(=O)c1ccc(cc1)N/C=C/1\C(=O)N(C)C(=O)C(=C1C)C#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 C17H15N3O4 MW 325.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N3O4/c1-10-13(8-18)15(21)20(2)16(22)14(10)9-19-12-6-4-11(5-7-12)17(23)24-3/h4-7,9,19H,1-3H3/b14-9-
InChIKey
SOKIGMAWUYGGDN-ZROIWOOFSA-N
Synonyms
354997-74-3
354997743
CC1=C(C(=O)N(C(=O)C1=CNC2=CC=C(C=C2)C(=O)OC)C)C#N
COC(=O)c1ccc(cc1)NC=C1C(=O)N(C)C(=O)C(=C1C)C#N
InChI=1SC17H15N3O4c11013(818)15(21)20(2)16(22)14(10)919126411(5712)17(23)243h47919H13H3b149
methyl4(((Z)(5cyano14dimethyl26dioxo16dihydropyridin3(2H)ylidene)methyl)amino)benzoate
methyl4(((Z)(5cyano14dimethyl26dioxopyridin3ylidene)methyl)amino)benzoate
MFCD01178673
ZINC000005333485
ZINC05333485
ZINC5333485

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Available files

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