Vitas-M small molecule compound
3-{(Z)-[3-(butan-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-9-methyl-2-(propylamino)-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK811872
SMILES CCCNc1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C(CC)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 C20H24N4O2S2 MW 416.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N4O2S2/c1-5-9-21-16-14(18(25)23-10-7-8-12(3)17(23)22-16)11-15-19(26)24(13(4)6-2)20(27)28-15/h7-8,10-11,13,21H,5-6,9H2,1-4H3/b15-11-InChIKey
XGCHZXVYVVQBBK-PTNGSMBKSA-NSynonyms
(5Z)3BUTAN2YL5((9METHYL4OXO2(PROPYLAMINO)PYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
3((Z)(3(butan2yl)4oxo2thioxo13thiazolidin5ylidene)methyl)9methyl2(propylamino)4Hpyrido(12a)pyrimidin4one
CCCNC1=C(C(=O)N2C=CC=C(C2=N1)C)C=C3C(=O)N(C(=S)S3)C(C)CC
CCCNc1nc2c(C)cccn2c(=O)c1C=C1SC(=S)N(C1=O)C(CC)C
InChI=1SC20H24N4O2S2c159211614(18(25)23107812(3)17(23)2216)111519(26)24(13(4)62)20(27)2815h7810111321H569H214H3b1511
MFCD03933165
ZINC000016713836
ZINC000016713838
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