Vitas-M small molecule compound
2-(cyclopentylamino)-3-{(Z)-[3-(4-methoxybenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK815406
SMILES COc1ccc(cc1)CN1C(=S)S/C(=C\c2c(NC3CCCC3)nc3n(c2=O)cccc3)/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 C25H24N4O3S2 MW 492.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O3S2/c1-32-18-11-9-16(10-12-18)15-29-24(31)20(34-25(29)33)14-19-22(26-17-6-2-3-7-17)27-21-8-4-5-13-28(21)23(19)30/h4-5,8-14,17,26H,2-3,6-7,15H2,1H3/b20-14-InChIKey
VJBRWGNHVTWUDB-ZHZULCJRSA-NSynonyms
(5Z)5((2(CYCLOPENTYLAMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3((4METHOXYPHENYL)METHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
2(cyclopentylamino)3((Z)(3(4methoxybenzyl)4oxo2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
COC1=CC=C(C=C1)CN2C(=O)C(=CC3=C(N=C4C=CC=CN4C3=O)NC5CCCC5)SC2=S
COc1ccc(cc1)CN1C(=S)SC(=Cc2c(NC3CCCC3)nc3n(c2=O)cccc3)C1=O
InChI=1SC25H24N4O3S2c1321811916(101218)152924(31)20(3425(29)33)141922(2617623717)27218451328(21)23(19)30h458141726H236715H21H3b2014
MFCD04442653
ZINC000001121509
ZINC1121509
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