Vitas-M small molecule compound
(6Z)-6-{4-[2-(4-tert-butylphenoxy)ethoxy]-3-methoxybenzylidene}-2-ethyl-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK094490
SMILES COc1cc(ccc1OCCOc1ccc(cc1)C(C)(C)C)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)CC
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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 C27H30N4O4S MW 506.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N4O4S/c1-6-23-30-31-24(28)20(25(32)29-26(31)36-23)15-17-7-12-21(22(16-17)33-5)35-14-13-34-19-10-8-18(9-11-19)27(2,3)4/h7-12,15-16,28H,6,13-14H2,1-5H3/b20-15-,28-24-InChIKey
AQEVWALWMHBMNH-VOGYXHDRSA-NSynonyms
(6Z)6(4(2(4tertbutylphenoxy)ethoxy)3methoxybenzylidene)2ethyl5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)6(4(2(4(tertbutyl)phenoxy)ethoxy)3methoxybenzylidene)2ethyl5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
COc1cc(ccc1OCCOc1ccc(cc1)C(C)(C)C)C=C1C(=O)N=c2n(C1=N)nc(s2)CC
MFCD02109874
STK094490
ZINC000008920959
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Check stock on Vitas-MAvailable files
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