Vitas-M small molecule compound
2-{(E)-[2-(1,1-dioxido-1,2-benzothiazol-3-yl)hydrazinylidene]methyl}phenyl benzoate
Catalog ID
STK136748
SMILES O=C(c1ccccc1)Oc1ccccc1/C=N/NC1=NS(=O)(=O)c2c1cccc2
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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 C21H15N3O4S MW 405.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15N3O4S/c25-21(15-8-2-1-3-9-15)28-18-12-6-4-10-16(18)14-22-23-20-17-11-5-7-13-19(17)29(26,27)24-20/h1-14H,(H,23,24)/b22-14+InChIKey
LMVOTNJOSVMEFO-HYARGMPZSA-NSynonyms
(2((E)((11DIOXO12BENZOTHIAZOL3YL)HYDRAZINYLIDENE)METHYL)PHENYL)BENZOATE
2((E)(2(11DIOXIDO12BENZOTHIAZOL3YL)HYDRAZINYLIDENE)METHYL)PHENYLBENZOATE
C1=CC=C(C=C1)C(=O)OC2=CC=CC=C2C=NNC3=NS(=O)(=O)C4=CC=CC=C43
InChI=1SC21H15N3O4Sc2521(158213915)281812641016(18)142223201711571319(17)29(2627)2420h114H(H2324)b2214+
MFCD01209217
O=C(c1ccccc1)Oc1ccccc1C=NNC1=NS(=O)(=O)c2c1cccc2
ZINC000001060681
ZINC32123446
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