Vitas-M small molecule compound

11-[(5Z)-5-(1-benzyl-5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]undecanoic acid

Catalog ID
STK702443
SMILES OC(=O)CCCCCCCCCCN1C(=S)S/C(=C\2/c3cc(Br)ccc3N(C2=O)Cc2ccccc2)/C1=O

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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 C29H31BrN2O4S2 MW 615.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31BrN2O4S2/c30-21-15-16-23-22(18-21)25(27(35)32(23)19-20-12-8-7-9-13-20)26-28(36)31(29(37)38-26)17-11-6-4-2-1-3-5-10-14-24(33)34/h7-9,12-13,15-16,18H,1-6,10-11,14,17,19H2,(H,33,34)/b26-25-
InChIKey
MEICYZNOGTXKCB-QPLCGJKRSA-N
Synonyms

(Z)11(5(1benzyl5bromo2oxoindolin3ylidene)4oxo2thioxothiazolidin3yl)undecanoicacid
11((5Z)5(1benzyl5bromo2oxo12dihydro3Hindol3ylidene)4oxo2thioxo13thiazolidin3yl)undecanoicacid
11((5Z)5(1BENZYL5BROMO2OXOINDOL3YLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)UNDECANOICACID
C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)Br)C(=C4C(=O)N(C(=S)S4)CCCCCCCCCCC(=O)O)C2=O
InChI=1SC29H31BrN2O4S2c302115162322(1821)25(27(35)32(23)1920128791320)2628(36)31(29(37)3826)1711642135101424(33)34h791213151618H161011141719H2(H3334)b2625
MFCD02988013
OC(=O)CCCCCCCCCCN1C(=S)SC(=C2c3cc(Br)ccc3N(C2=O)Cc2ccccc2)C1=O
ZINC000100836774
ZINC100836774

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Available files

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