Vitas-M small molecule compound

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

Catalog ID
STK702398
SMILES OC(=O)CN1C(=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 C20H13BrN2O4S2 MW 489.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13BrN2O4S2/c21-12-6-7-14-13(8-12)16(17-19(27)23(10-15(24)25)20(28)29-17)18(26)22(14)9-11-4-2-1-3-5-11/h1-8H,9-10H2,(H,24,25)/b17-16-
InChIKey
OPMBYWUSDMJJED-MSUUIHNZSA-N
Synonyms

((5Z)5(1benzyl5bromo2oxo12dihydro3Hindol3ylidene)4oxo2thioxo13thiazolidin3yl)aceticacid
(Z)2(5(1benzyl5bromo2oxoindolin3ylidene)4oxo2thioxothiazolidin3yl)aceticacid
2((5Z)5(1BENZYL5BROMO2OXOINDOL3YLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETICACID
C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)Br)C(=C4C(=O)N(C(=S)S4)CC(=O)O)C2=O
InChI=1SC20H13BrN2O4S2c2112671413(812)16(1719(27)23(1015(24)25)20(28)2917)18(26)22(14)9114213511h18H910H2(H2425)b1716
MFCD02992880
OC(=O)CN1C(=S)SC(=C2c3cc(Br)ccc3N(C2=O)Cc2ccccc2)C1=O
ZINC000001766380
ZINC1766380

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Available files

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