Vitas-M small molecule compound
(2Z)-2-[(2E)-(1,3-benzodioxol-5-ylmethylidene)hydrazinylidene]-3-benzyl-2,3-dihydro-1,3-benzothiazole
Catalog ID
STK179744
SMILES c1ccc(cc1)Cn1/c(=N/N=C/c2ccc3c(c2)OCO3)/sc2c1cccc2
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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 C22H17N3O2S MW 387.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O2S/c1-2-6-16(7-3-1)14-25-18-8-4-5-9-21(18)28-22(25)24-23-13-17-10-11-19-20(12-17)27-15-26-19/h1-13H,14-15H2/b23-13+,24-22-InChIKey
MAODGSAKGXAUFI-KRLZMICPSA-NSynonyms
(2Z)2((2E)(13BENZODIOXOL5YLMETHYLIDENE)HYDRAZINYLIDENE)3BENZYL23DIHYDRO13BENZOTHIAZOLE
(E)N((E)13benzodioxol5ylmethylideneamino)3benzyl13benzothiazol2imine
c1ccc(cc1)Cn1c(=NN=Cc2ccc3c(c2)OCO3)sc2c1cccc2
C1OC2=C(O1)C=C(C=C2)C=NN=C3N(C4=CC=CC=C4S3)CC5=CC=CC=C5
InChI=1SC22H17N3O2Sc12616(731)142518845921(18)2822(25)2423131710111920(1217)27152619h113H1415H2b2313+2422
MFCD01028517
ZINC000004705076
ZINC36130025
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