Vitas-M small molecule compound
7-methyl-3-[(Z)-(3-octyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-(prop-2-en-1-ylamino)-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK705258
SMILES CCCCCCCCN1C(=S)S/C(=C\c2c(NCC=C)nc3n(c2=O)cc(cc3)C)/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 C24H30N4O2S2 MW 470.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H30N4O2S2/c1-4-6-7-8-9-10-14-27-23(30)19(32-24(27)31)15-18-21(25-13-5-2)26-20-12-11-17(3)16-28(20)22(18)29/h5,11-12,15-16,25H,2,4,6-10,13-14H2,1,3H3/b19-15-InChIKey
AHQXCUNCKFTZMQ-CYVLTUHYSA-NSynonyms
(5Z)5((7METHYL4OXO2(PROP2ENYLAMINO)PYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3OCTYL2SULFANYLIDENE13THIAZOLIDIN4ONE
7methyl3((Z)(3octyl4oxo2thioxo13thiazolidin5ylidene)methyl)2(prop2en1ylamino)4Hpyrido(12a)pyrimidin4one
CCCCCCCCN1C(=O)C(=CC2=C(N=C3C=CC(=CN3C2=O)C)NCC=C)SC1=S
CCCCCCCCN1C(=S)SC(=Cc2c(NCC=C)nc3n(c2=O)cc(cc3)C)C1=O
InChI=1SC24H30N4O2S2c14678910142723(30)19(3224(27)31)151821(251352)2620121117(3)1628(20)22(18)29h51112151625H246101314H213H3b1915
MFCD04491499
ZINC000097946617
ZINC97946617
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