Vitas-M small molecule compound
(6Z)-3-(benzylsulfanyl)-5-imino-6-({1-[2-(3-methoxyphenoxy)ethyl]-1H-pyrrol-2-yl}methylidene)-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one
Catalog ID
STK844927
SMILES COc1cccc(c1)OCCn1cccc1/C=C/1\C(=O)N=c2n(C1=N)c(SCc1ccccc1)ns2
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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 C26H23N5O3S2 MW 517.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N5O3S2/c1-33-20-10-5-11-21(16-20)34-14-13-30-12-6-9-19(30)15-22-23(27)31-25(28-24(22)32)36-29-26(31)35-17-18-7-3-2-4-8-18/h2-12,15-16,27H,13-14,17H2,1H3/b22-15-,27-23-InChIKey
PCVYDGSTQYXFBL-TVUFKDQDSA-NSynonyms
683804-89-9(6Z)3(benzylsulfanyl)5imino6((1(2(3methoxyphenoxy)ethyl)1Hpyrrol2yl)methylidene)56dihydro7H(124)thiadiazolo(45a)pyrimidin7one
(Z)3(benzylthio)5imino6((1(2(3methoxyphenoxy)ethyl)1Hpyrrol2yl)methylene)5H(124)thiadiazolo(45a)pyrimidin7(6H)one
683804899
COc1cccc(c1)OCCn1cccc1C=C1C(=O)N=c2n(C1=N)c(SCc1ccccc1)ns2
MFCD04006946
ZINC000031932592
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