Vitas-M small molecule compound
9-methyl-3-{(Z)-[4-oxo-3-(propan-2-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK798632
SMILES CC(N1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCCCC2)/C1=O)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 C21H24N4O2S2 MW 428.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O2S2/c1-13(2)25-20(27)16(29-21(25)28)12-15-18(23-9-5-4-6-10-23)22-17-14(3)8-7-11-24(17)19(15)26/h7-8,11-13H,4-6,9-10H2,1-3H3/b16-12-InChIKey
DGLATNVCNUAGDY-VBKFSLOCSA-NSynonyms
(5Z)5((9METHYL4OXO2PIPERIDIN1YLPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3PROPAN2YL2SULFANYLIDENE13THIAZOLIDIN4ONE
9methyl3((Z)(4oxo3(propan2yl)2thioxo13thiazolidin5ylidene)methyl)2(piperidin1yl)4Hpyrido(12a)pyrimidin4one
CC(N1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3C)N2CCCCC2)C1=O)C
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)C(C)C)N4CCCCC4
InChI=1SC21H24N4O2S2c113(2)2520(27)16(2921(25)28)121518(2395461023)221714(3)871124(17)19(15)26h781113H46910H213H3b1612
MFCD03462035
ZINC000001474163
ZINC1474163
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