Vitas-M small molecule compound
(5Z)-3-(3-ethoxypropyl)-5-({1-phenyl-3-[4-(propan-2-yloxy)phenyl]-1H-pyrazol-4-yl}methylidene)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK799064
SMILES CCOCCCN1C(=S)S/C(=C\c2cn(nc2c2ccc(cc2)OC(C)C)c2ccccc2)/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 C27H29N3O3S2 MW 507.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O3S2/c1-4-32-16-8-15-29-26(31)24(35-27(29)34)17-21-18-30(22-9-6-5-7-10-22)28-25(21)20-11-13-23(14-12-20)33-19(2)3/h5-7,9-14,17-19H,4,8,15-16H2,1-3H3/b24-17-InChIKey
MSRCFLCPFRHATE-ULJHMMPZSA-NSynonyms
(5Z)3(3ethoxypropyl)5((1phenyl3(4(propan2yloxy)phenyl)1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5Z)3(3ETHOXYPROPYL)5((1PHENYL3(4PROPAN2YLOXYPHENYL)PYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
CCOCCCN1C(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)OC(C)C)C4=CC=CC=C4)SC1=S
CCOCCCN1C(=S)SC(=Cc2cn(nc2c2ccc(cc2)OC(C)C)c2ccccc2)C1=O
InChI=1SC27H29N3O3S2c1432168152926(31)24(3527(29)34)17211830(2296571022)2825(21)20111323(141220)3319(2)3h579141719H481516H213H3b2417
MFCD03462239
ZINC000016700689
ZINC16700689
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