Vitas-M small molecule compound
(5Z)-5-(5-chloro-2-{3-[5-methyl-2-(propan-2-yl)phenoxy]propoxy}benzylidene)-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK002419
SMILES C=CCN1C(=S)S/C(=C\c2cc(Cl)ccc2OCCCOc2cc(C)ccc2C(C)C)/C1=O
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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 C26H28ClNO3S2 MW 502.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28ClNO3S2/c1-5-11-28-25(29)24(33-26(28)32)16-19-15-20(27)8-10-22(19)30-12-6-13-31-23-14-18(4)7-9-21(23)17(2)3/h5,7-10,14-17H,1,6,11-13H2,2-4H3/b24-16-InChIKey
TXTBEOHTUKGCOB-JLPGSUDCSA-NSynonyms
(5Z)5((5chloro2(3(5methyl2propan2ylphenoxy)propoxy)phenyl)methylidene)3prop2enyl2sulfanylidene13thiazolidin4one
(5Z)5(5CHLORO2(3(5METHYL2(PROPAN2YL)PHENOXY)PROPOXY)BENZYLIDENE)3(PROP2EN1YL)2THIOXO13THIAZOLIDIN4ONE
C=CCN1C(=S)SC(=Cc2cc(Cl)ccc2OCCCOc2cc(C)ccc2C(C)C)C1=O
CC1=CC(=C(C=C1)C(C)C)OCCCOC2=C(C=C(C=C2)Cl)C=C3C(=O)N(C(=S)S3)CC=C
InChI=1SC26H28ClNO3S2c15112825(29)24(3326(28)32)16191520(27)81022(19)301261331231418(4)7921(23)17(2)3h57101417H161113H224H3b2416
MFCD05976434
STK002419
ZINC000008916146
ZINC08916146
ZINC8916146
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