Vitas-M small molecule compound

(4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2-(2-chloro-5-iodophenyl)-1,3-oxazol-5(4H)-one

Catalog ID
STK370329
SMILES Ic1ccc(c(c1)C1=N/C(=C\c2ccc3c(c2)OCO3)/C(=O)O1)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 C17H9ClINO4 MW 453.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H9ClINO4/c18-12-3-2-10(19)7-11(12)16-20-13(17(21)24-16)5-9-1-4-14-15(6-9)23-8-22-14/h1-7H,8H2/b13-5-
InChIKey
RBZHDWLVIMNHAE-ACAGNQJTSA-N
Synonyms

(4Z)4(13benzodioxol5ylmethylidene)2(2chloro5iodophenyl)13oxazol5(4H)one
(4Z)4(13BENZODIOXOL5YLMETHYLIDENE)2(2CHLORO5IODOPHENYL)13OXAZOL5ONE
4(13BENZODIOXOL5YLMETHYLENE)2(2CHLORO5IODOPHENYL)13OXAZOL5(4H)ONE
4(2HBENZO(34D)13DIOXOLAN5YLMETHYLENE)2(2CHLORO5IODOPHENYL)13OXAZOLIN5ONE
4BENZO(13)DIOXOL5YLMETHYLENE2(2CHLORO5IODOPHENYL)4HOXAZOL5ONE
C1OC2=C(O1)C=C(C=C2)C=C3C(=O)OC(=N3)C4=C(C=CC(=C4)I)Cl
Ic1ccc(c(c1)C1=NC(=Cc2ccc3c(c2)OCO3)C(=O)O1)Cl
InChI=1SC17H9ClINO4c18123210(19)711(12)162013(17(21)2416)59141415(69)2382214h17H8H2b135
MFCD00385185
ZINC000000865426
ZINC00865426
ZINC865426

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Available files

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