Vitas-M small molecule compound

methyl 4-{(Z)-[2-(3-iodophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}benzoate

Catalog ID
STK837931
SMILES COC(=O)c1ccc(cc1)/C=C/1\N=C(OC1=O)c1cccc(c1)I

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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 C18H12INO4 MW 433.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12INO4/c1-23-17(21)12-7-5-11(6-8-12)9-15-18(22)24-16(20-15)13-3-2-4-14(19)10-13/h2-10H,1H3/b15-9-
InChIKey
IAVVPJOLPGLYKO-DHDCSXOGSA-N
Synonyms

(Z)methyl4((2(3iodophenyl)5oxooxazol4(5H)ylidene)methyl)benzoate
COC(=O)C1=CC=C(C=C1)C=C2C(=O)OC(=N2)C3=CC(=CC=C3)I
COC(=O)c1ccc(cc1)C=C1N=C(OC1=O)c1cccc(c1)I
InChI=1SC18H12INO4c12317(21)127511(6812)91518(22)2416(2015)1332414(19)1013h210H1H3b159
methyl4((Z)(2(3iodophenyl)5oxo13oxazol4(5H)ylidene)methyl)benzoate
METHYL4((Z)(2(3IODOPHENYL)5OXO13OXAZOL4YLIDENE)METHYL)BENZOATE
MFCD01931181
ZINC000000822637
ZINC00822637
ZINC822637

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.