Vitas-M small molecule compound
3-[(Z)-{3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}methyl]-2-(propan-2-ylamino)-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK543551
SMILES COc1cc(CCN2C(=S)S/C(=C\c3c(NC(C)C)nc4n(c3=O)cccc4)/C2=O)ccc1OC
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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 C25H26N4O4S2 MW 510.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O4S2/c1-15(2)26-22-17(23(30)28-11-6-5-7-21(28)27-22)14-20-24(31)29(25(34)35-20)12-10-16-8-9-18(32-3)19(13-16)33-4/h5-9,11,13-15,26H,10,12H2,1-4H3/b20-14-InChIKey
LGOOWLUKJYVZOS-ZHZULCJRSA-NSynonyms
488107-24-0(5Z)3(2(34DIMETHOXYPHENYL)ETHYL)5((4OXO2(PROPAN2YLAMINO)PYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(34dimethoxyphenethyl)5((2(isopropylamino)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3(2(34dimethoxyphenyl)ethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)2(propan2ylamino)4Hpyrido(12a)pyrimidin4one
488107240
CC(C)NC1=C(C(=O)N2C=CC=CC2=N1)C=C3C(=O)N(C(=S)S3)CCC4=CC(=C(C=C4)OC)OC
COc1cc(CCN2C(=S)SC(=Cc3c(NC(C)C)nc4n(c3=O)cccc4)C2=O)ccc1OC
InChI=1SC25H26N4O4S2c115(2)262217(23(30)281165721(28)2722)142024(31)29(25(34)3520)1210168918(323)19(1316)334h5911131526H1012H214H3b2014
MFCD03288811
ZINC000002328558
ZINC2328558
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.