Vitas-M small molecule compound

N~2~-{(1E)-1-[(9bR)-6-acetyl-7,9-dihydroxy-8,9b-dimethyl-1,3-dioxo-3,9b-dihydrodibenzo[b,d]furan-2(1H)-ylidene]ethyl}-N-1,3-thiazol-2-ylglycinamide

Catalog ID
STL545996
SMILES O=C(Nc1nccs1)CN/C(=C/1\C(=O)C=C2[C@@](C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)/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 C23H21N3O7S MW 483.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O7S/c1-9-18(30)16(11(3)27)20-17(19(9)31)23(4)13(33-20)7-12(28)15(21(23)32)10(2)25-8-14(29)26-22-24-5-6-34-22/h5-7,25,30-31H,8H2,1-4H3,(H,24,26,29)/b15-10+/t23-/m0/s1
InChIKey
RLXGHRPRQUCCTH-VOCPSOEZSA-N
Synonyms

(RE)2((1(6acetyl79dihydroxy89bdimethyl13dioxo19bdihydrodibenzo(bd)furan2(3H)ylidene)ethyl)amino)N(thiazol2yl)acetamide
110207169
2(((1~(E))1((9~(b)~(R))6acetyl79dihydroxy89~(b)dimethyl13dioxodibenzofuran2ylidene)ethyl)amino)~(N)(13thiazol2yl)acetamide
InChI=1SC23H21N3O7Sc1918(30)16(11(3)27)2017(19(9)31)23(4)13(3320)712(28)15(21(23)32)10(2)25814(29)262224563422h57253031H8H214H3(H242629)b1510+t23m0s1
N~2~((1E)1((9bR)6acetyl79dihydroxy89bdimethyl13dioxo39bdihydrodibenzo(bd)furan2(1H)ylidene)ethyl)N13thiazol2ylglycinamide
N2((1E)1((9BR)6ACETYL79DIHYDROXY89BDIMETHYL13DIOXO39BDIHYDRODIBENZO(BD)FURAN2(1H)YLIDENE)ETHYL)N13THIAZOL2YLGLYCINAMIDE
O=C(Nc1nccs1)CNC(=C1C(=O)C=C2(C@@)(C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)C
ZINC000253412596
ZINC253412596

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Available files

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