Vitas-M small molecule compound
3-[(Z)-(3-hexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-[(4-methoxybenzyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK816724
SMILES CCCCCCN1C(=S)S/C(=C\c2c(NCc3ccc(cc3)OC)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 C26H28N4O3S2 MW 508.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N4O3S2/c1-3-4-5-7-15-30-25(32)21(35-26(30)34)16-20-23(27-17-18-10-12-19(33-2)13-11-18)28-22-9-6-8-14-29(22)24(20)31/h6,8-14,16,27H,3-5,7,15,17H2,1-2H3/b21-16-InChIKey
IZWIAFQHTGWKTQ-PGMHBOJBSA-NSynonyms
(5Z)3HEXYL5((2((4METHOXYPHENYL)METHYLAMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
3((Z)(3hexyl4oxo2thioxo13thiazolidin5ylidene)methyl)2((4methoxybenzyl)amino)4Hpyrido(12a)pyrimidin4one
CCCCCCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)NCC4=CC=C(C=C4)OC)SC1=S
CCCCCCN1C(=S)SC(=Cc2c(NCc3ccc(cc3)OC)nc3n(c2=O)cccc3)C1=O
InChI=1SC26H28N4O3S2c13457153025(32)21(3526(30)34)162023(271718101219(332)131118)28229681429(22)24(20)31h68141627H3571517H212H3b2116
MFCD03212730
ZINC000016733654
ZINC16733654
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