Vitas-M small molecule compound
2-[(1-hydroxybutan-2-yl)amino]-9-methyl-3-{(Z)-[4-oxo-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STL336554
SMILES C=CCN1C(=S)S/C(=C\c2c(NC(CO)CC)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 C20H22N4O3S2 MW 430.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O3S2/c1-4-8-24-19(27)15(29-20(24)28)10-14-16(21-13(5-2)11-25)22-17-12(3)7-6-9-23(17)18(14)26/h4,6-7,9-10,13,21,25H,1,5,8,11H2,2-3H3/b15-10-InChIKey
PRCXVXJOKMODHF-GDNBJRDFSA-NSynonyms
615272-28-1(5Z)5((2(1HYDROXYBUTAN2YLAMINO)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3PROP2ENYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3allyl5((2((1hydroxybutan2yl)amino)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
2((1hydroxybutan2yl)amino)9methyl3((Z)(4oxo3(prop2en1yl)2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
5((2((1ETHYL2HYDROXYETHYL)AMINO)9METHYL4OXO(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)3PROP2ENYL2THIOXO13THIAZOLIDIN4ONE
615272281
C=CCN1C(=S)SC(=Cc2c(NC(CO)CC)nc3n(c2=O)cccc3C)C1=O
CCC(CO)NC1=C(C(=O)N2C=CC=C(C2=N1)C)C=C3C(=O)N(C(=S)S3)CC=C
InChI=1SC20H22N4O3S2c1482419(27)15(2920(24)28)101416(2113(52)1125)221712(3)76923(17)18(14)26h467910132125H15811H223H3b1510
MFCD03667055
ZINC000001480725
ZINC000008857880
Check stock
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Check stock on Vitas-MAvailable files
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