Vitas-M small molecule compound
(2E)-13-acetyl-2-{[5-(3-chlorophenyl)furan-2-yl]methylidene}-5-methyl-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocin-1(2H)-one
Catalog ID
STK956430
SMILES Clc1cccc(c1)c1ccc(o1)/C=c\1/sc2=NC3(C(C(n2c1=O)c1ccccc1O3)C(=O)C)C
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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 C26H19ClN2O4S MW 490.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19ClN2O4S/c1-14(30)22-23-18-8-3-4-9-20(18)33-26(22,2)28-25-29(23)24(31)21(34-25)13-17-10-11-19(32-17)15-6-5-7-16(27)12-15/h3-13,22-23H,1-2H3/b21-13+InChIKey
STPVGLDMDGOINM-FYJGNVAPSA-NSynonyms
1025637-33-5(2E)13acetyl2((5(3chlorophenyl)furan2yl)methylidene)5methyl5H11H511methano(13)thiazolo(23d)(135)benzoxadiazocin1(2H)one
1025637335
CC(=O)C1C2C3=CC=CC=C3OC1(N=C4N2C(=O)C(=CC5=CC=C(O5)C6=CC(=CC=C6)Cl)S4)C
Clc1cccc(c1)c1ccc(o1)C=c1sc2=NC3(C(C(n2c1=O)c1ccccc1O3)C(=O)C)C
InChI=1SC26H19ClN2O4Sc114(30)222318834920(18)3326(222)282529(23)24(31)21(3425)1317101119(3217)1565716(27)1215h3132223H12H3b2113+
MFCD03466951
ZINC000169700480
ZINC000169700482
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