Vitas-M small molecule compound

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

Catalog ID
STK828152
SMILES CCOc1cc(ccc1OCCOc1cccc(c1)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 C26H28N4O4S MW 492.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N4O4S/c1-5-32-22-15-18(9-10-21(22)34-12-11-33-19-8-6-7-17(4)13-19)14-20-23(27)30-26(28-24(20)31)35-25(29-30)16(2)3/h6-10,13-16,27H,5,11-12H2,1-4H3/b20-14-,27-23-
InChIKey
SKXXHLLEQXVDSN-XCAZPQICSA-N
Synonyms

(6Z)6(3ethoxy4(2(3methylphenoxy)ethoxy)benzylidene)5imino2(propan2yl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)6(3ethoxy4(2(mtolyloxy)ethoxy)benzylidene)5imino2isopropyl5H(134)thiadiazolo(32a)pyrimidin7(6H)one
CCOc1cc(ccc1OCCOc1cccc(c1)C)C=C1C(=O)N=c2n(C1=N)nc(s2)C(C)C
MFCD02118386
ZINC000008453073

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Available files

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