Vitas-M small molecule compound
(6Z)-6-{4-[2-(4-tert-butylphenoxy)ethoxy]-3-ethoxybenzylidene}-2-cyclohexyl-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK014164
SMILES CCOc1cc(ccc1OCCOc1ccc(cc1)C(C)(C)C)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)C1CCCCC1
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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 C32H38N4O4S MW 574.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H38N4O4S/c1-5-38-27-20-21(11-16-26(27)40-18-17-39-24-14-12-23(13-15-24)32(2,3)4)19-25-28(33)36-31(34-29(25)37)41-30(35-36)22-9-7-6-8-10-22/h11-16,19-20,22,33H,5-10,17-18H2,1-4H3/b25-19-,33-28-InChIKey
XLHKEEIDDPKJEI-VWADLEFASA-NSynonyms
(6Z)6(4(2(4tertbutylphenoxy)ethoxy)3ethoxybenzylidene)2cyclohexyl5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
CCOc1cc(ccc1OCCOc1ccc(cc1)C(C)(C)C)C=C1C(=O)N=c2n(C1=N)nc(s2)C1CCCCC1
MFCD08049531
STK014164
ZINC000097957923
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