Vitas-M small molecule compound

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

Catalog ID
STL239247
SMILES Clc1ccc(cc1)SCCOc1ccc(cc1)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)c1cccnc1

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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 C25H18ClN5O2S2 MW 520.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18ClN5O2S2/c26-18-5-9-20(10-6-18)34-13-12-33-19-7-3-16(4-8-19)14-21-22(27)31-25(29-23(21)32)35-24(30-31)17-2-1-11-28-15-17/h1-11,14-15,27H,12-13H2/b21-14-,27-22-
InChIKey
XCWOZUUXSCULAQ-VWRJUWLASA-N
Synonyms
877622-77-0
(6Z)6(4(2((4chlorophenyl)sulfanyl)ethoxy)benzylidene)5imino2(pyridin3yl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)6(4(2((4chlorophenyl)thio)ethoxy)benzylidene)5imino2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
877622770
Clc1ccc(cc1)SCCOc1ccc(cc1)C=C1C(=O)N=c2n(C1=N)nc(s2)c1cccnc1
MFCD05706497
ZINC000101254695

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Available files

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