Vitas-M small molecule compound
3-[(Z)-{3-[2-(4-methoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}methyl]-9-methyl-2-[(tetrahydrofuran-2-ylmethyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STL336179
SMILES COc1ccc(cc1)CCN1C(=S)S/C(=C\c2c(NCC3CCCO3)nc3n(c2=O)cccc3C)/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 C27H28N4O4S2 MW 536.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O4S2/c1-17-5-3-12-30-24(17)29-23(28-16-20-6-4-14-35-20)21(25(30)32)15-22-26(33)31(27(36)37-22)13-11-18-7-9-19(34-2)10-8-18/h3,5,7-10,12,15,20,28H,4,6,11,13-14,16H2,1-2H3/b22-15-InChIKey
FTUHYMCQMFLAQV-JCMHNJIXSA-NSynonyms
797021-84-2(5Z)3(2(4METHOXYPHENYL)ETHYL)5((9METHYL4OXO2(OXOLAN2YLMETHYLAMINO)PYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(4methoxyphenethyl)5((9methyl4oxo2(((tetrahydrofuran2yl)methyl)amino)4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3(2(4methoxyphenyl)ethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)9methyl2((tetrahydrofuran2ylmethyl)amino)4Hpyrido(12a)pyrimidin4one
797021842
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CCC4=CC=C(C=C4)OC)NCC5CCCO5
COc1ccc(cc1)CCN1C(=S)SC(=Cc2c(NCC3CCCO3)nc3n(c2=O)cccc3C)C1=O
InChI=1SC27H28N4O4S2c11753123024(17)2923(28162064143520)21(25(30)32)152226(33)31(27(36)3722)1311187919(342)10818h3571012152028H4611131416H212H3b2215
MFCD03663918
ZINC000100913553
ZINC000100913554
Check stock
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