Vitas-M small molecule compound
(5Z)-5-[3-chloro-5-methoxy-4-(prop-2-yn-1-yloxy)benzylidene]-3-(2-methoxyethyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK035082
SMILES COCCN1C(=S)S/C(=C\c2cc(Cl)c(c(c2)OC)OCC#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 C17H16ClNO4S2 MW 397.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16ClNO4S2/c1-4-6-23-15-12(18)8-11(9-13(15)22-3)10-14-16(20)19(5-7-21-2)17(24)25-14/h1,8-10H,5-7H2,2-3H3/b14-10-InChIKey
OUJXWNUAMNXHPL-UVTDQMKNSA-NSynonyms
(5Z)5((3CHLORO5METHOXY4PROP2YNOXYPHENYL)METHYLIDENE)3(2METHOXYETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5(3CHLORO5METHOXY4(PROP2YN1YLOXY)BENZYLIDENE)3(2METHOXYETHYL)2THIOXO13THIAZOLIDIN4ONE
COCCN1C(=O)C(=CC2=CC(=C(C(=C2)Cl)OCC#C)OC)SC1=S
COCCN1C(=S)SC(=Cc2cc(Cl)c(c(c2)OC)OCC#C)C1=O
InChI=1SC17H16ClNO4S2c146231512(18)811(913(15)223)101416(20)19(57212)17(24)2514h1810H57H223H3b1410
MFCD03705743
STK035082
ZINC000002986583
ZINC02986583
ZINC2986583
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