Vitas-M small molecule compound
2-(1,3-benzothiazol-2-ylsulfanyl)-N'-{(E)-[3-({[4-(difluoromethyl)-6-methylpyrimidin-2-yl]sulfanyl}methyl)-4-methoxyphenyl]methylidene}propanehydrazide
Catalog ID
STK465621
SMILES COc1ccc(cc1CSc1nc(C)cc(n1)C(F)F)/C=N/NC(=O)C(Sc1nc2c(s1)cccc2)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 C25H23F2N5O2S3 MW 559.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23F2N5O2S3/c1-14-10-19(22(26)27)30-24(29-14)35-13-17-11-16(8-9-20(17)34-3)12-28-32-23(33)15(2)36-25-31-18-6-4-5-7-21(18)37-25/h4-12,15,22H,13H2,1-3H3,(H,32,33)/b28-12+InChIKey
ZCGLQIIJGFHWFJ-KVSWJAHQSA-NSynonyms
2(13benzothiazol2ylsulfanyl)N((E)(3(((4(difluoromethyl)6methylpyrimidin2yl)sulfanyl)methyl)4methoxyphenyl)methylidene)propanehydrazide
2(13benzothiazol2ylsulfanyl)N((E)(3((4(difluoromethyl)6methylpyrimidin2yl)sulfanylmethyl)4methoxyphenyl)methylideneamino)propanamide
CC1=CC(=NC(=N1)SCC2=C(C=CC(=C2)C=NNC(=O)C(C)SC3=NC4=CC=CC=C4S3)OC)C(F)F
COc1ccc(cc1CSc1nc(C)cc(n1)C(F)F)C=NNC(=O)C(Sc1nc2c(s1)cccc2)C
InChI=1SC25H23F2N5O2S3c1141019(22(26)27)3024(2914)3513171116(8920(17)343)12283223(33)15(2)36253118645721(18)3725h4121522H13H213H3(H3233)b2812+
MFCD06759305
ZINC000097965693
ZINC000097965694
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