Vitas-M small molecule compound
3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-2-(propan-2-yl)-4H-chromen-7-yl 3-cyclopentylpropanoate
Catalog ID
STK543446
SMILES O=C(Oc1ccc2c(c1C)oc(c(c2=O)c1nc2c(s1)cccc2)C(C)C)CCC1CCCC1
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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 C28H29NO4S MW 475.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29NO4S/c1-16(2)26-24(28-29-20-10-6-7-11-22(20)34-28)25(31)19-13-14-21(17(3)27(19)33-26)32-23(30)15-12-18-8-4-5-9-18/h6-7,10-11,13-14,16,18H,4-5,8-9,12,15H2,1-3H3InChIKey
NGLZFJVFIHSTBJ-UHFFFAOYSA-NSynonyms
488744-20-3(3(13BENZOTHIAZOL2YL)8METHYL4OXO2PROPAN2YLCHROMEN7YL)3CYCLOPENTYLPROPANOATE
3(13benzothiazol2yl)8methyl4oxo2(propan2yl)4Hchromen7yl3cyclopentylpropanoate
3(benzo(d)thiazol2yl)2isopropyl8methyl4oxo4Hchromen7yl3cyclopentylpropanoate
3BENZOTHIAZOL2YL8METHYL2(METHYLETHYL)4OXOCHROMEN7YL3CYCLOPENTYLPROPANOATE
488744203
CC1=C(C=CC2=C1OC(=C(C2=O)C3=NC4=CC=CC=C4S3)C(C)C)OC(=O)CCC5CCCC5
InChI=1SC28H29NO4Sc116(2)2624(28292010671122(20)3428)25(31)19131421(17(3)27(19)3326)3223(30)151218845918h67101113141618H45891215H213H3
MFCD03292187
ZINC000001831560
ZINC01831560
ZINC1831560
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