Vitas-M small molecule compound

(2S)-N-[(2Z)-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1,3-thiazol-2(3H)-ylidene]-3-methyl-2-(1H-tetrazol-1-yl)pentanamide

Catalog ID
STL569827
SMILES CC[C@@H]([C@H](n1cnnn1)C(=O)/N=c/1\scc([nH]1)c1ccc2c(c1)OCCCO2)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 C19H22N6O3S MW 414.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N6O3S/c1-3-12(2)17(25-11-20-23-24-25)18(26)22-19-21-14(10-29-19)13-5-6-15-16(9-13)28-8-4-7-27-15/h5-6,9-12,17H,3-4,7-8H2,1-2H3,(H,21,22,26)/t12-,17-/m0/s1
InChIKey
TYTHDDJWPOZAFS-SJCJKPOMSA-N
Synonyms

(2S)N((2Z)4(34dihydro2H15benzodioxepin7yl)13thiazol2(3H)ylidene)3methyl2(1Htetrazol1yl)pentanamide
(2S3S)N(4(34dihydro2H15benzodioxepin7yl)13thiazol2yl)3methyl2(tetrazol1yl)pentanamide
127254596
InChI=1SC19H22N6O3Sc1312(2)17(251120232425)18(26)22192114(102919)13561516(913)288472715h5691217H3478H212H3(H212226)t1217m0s1
MFCD32654709
ZINC000604418904

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Available files

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