Vitas-M small molecule compound

(6Z)-6-{4-[2-(4-tert-butylphenoxy)ethoxy]-3-ethoxybenzylidene}-5-imino-2-(propan-2-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

Catalog ID
STK028586
SMILES CCOc1cc(ccc1OCCOc1ccc(cc1)C(C)(C)C)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)C(C)C

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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 C29H34N4O4S MW 534.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N4O4S/c1-7-35-24-17-19(16-22-25(30)33-28(31-26(22)34)38-27(32-33)18(2)3)8-13-23(24)37-15-14-36-21-11-9-20(10-12-21)29(4,5)6/h8-13,16-18,30H,7,14-15H2,1-6H3/b22-16-,30-25-
InChIKey
CLUOYJGLPUMTDS-KFTYTRQPSA-N
Synonyms

(6Z)6(4(2(4tertbutylphenoxy)ethoxy)3ethoxybenzylidene)5imino2(propan2yl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
CCOc1cc(ccc1OCCOc1ccc(cc1)C(C)(C)C)C=C1C(=O)N=c2n(C1=N)nc(s2)C(C)C
MFCD08050185
STK028586
ZINC000100656702

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Available files

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