Vitas-M small molecule compound
(3Z)-5-bromo-3-{3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}-1-hexyl-1,3-dihydro-2H-indol-2-one
Catalog ID
STK814912
SMILES CCCCCCN1C(=O)/C(=C/2\SC(=S)N(C2=O)CCc2ccc(c(c2)OC)OC)/c2c1ccc(c2)Br
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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 C27H29BrN2O4S2 MW 589.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29BrN2O4S2/c1-4-5-6-7-13-29-20-10-9-18(28)16-19(20)23(25(29)31)24-26(32)30(27(35)36-24)14-12-17-8-11-21(33-2)22(15-17)34-3/h8-11,15-16H,4-7,12-14H2,1-3H3/b24-23-InChIKey
DXZDTXJJHCZWSA-VHXPQNKSSA-NSynonyms
(3Z)5bromo3(3(2(34dimethoxyphenyl)ethyl)4oxo2thioxo13thiazolidin5ylidene)1hexyl13dihydro2Hindol2one
(5Z)5(5BROMO1HEXYL2OXOINDOL3YLIDENE)3(2(34DIMETHOXYPHENYL)ETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
CCCCCCN1C(=O)C(=C2SC(=S)N(C2=O)CCc2ccc(c(c2)OC)OC)c2c1ccc(c2)Br
CCCCCCN1C2=C(C=C(C=C2)Br)C(=C3C(=O)N(C(=S)S3)CCC4=CC(=C(C=C4)OC)OC)C1=O
InChI=1SC27H29BrN2O4S2c1456713292010918(28)1619(20)23(25(29)31)2426(32)30(27(35)3624)14121781121(332)22(1517)343h8111516H471214H213H3b2423
MFCD04442398
ZINC000100893017
ZINC100893017
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