Vitas-M small molecule compound
2-[(4-methoxybenzyl)amino]-9-methyl-3-{(Z)-[3-(2-methylpropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK811705
SMILES COc1ccc(cc1)CNc1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CC(C)C
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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 C25H26N4O3S2 MW 494.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O3S2/c1-15(2)14-29-24(31)20(34-25(29)33)12-19-21(26-13-17-7-9-18(32-4)10-8-17)27-22-16(3)6-5-11-28(22)23(19)30/h5-12,15,26H,13-14H2,1-4H3/b20-12-InChIKey
SHXFNBGYHUUZHH-NDENLUEZSA-NSynonyms
(5Z)5((2((4METHOXYPHENYL)METHYLAMINO)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3(2METHYLPROPYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
2((4methoxybenzyl)amino)9methyl3((Z)(3(2methylpropyl)4oxo2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CC(C)C)NCC4=CC=C(C=C4)OC
COc1ccc(cc1)CNc1nc2c(C)cccn2c(=O)c1C=C1SC(=S)N(C1=O)CC(C)C
InChI=1SC25H26N4O3S2c115(2)142924(31)20(3425(29)33)121921(2613177918(324)10817)272216(3)651128(22)23(19)30h5121526H1314H214H3b2012
MFCD03212752
ZINC000002520577
ZINC2520577
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