Vitas-M small molecule compound
2-(1,3-benzodioxol-5-yl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine
Catalog ID
STL170310
SMILES c1ccc(cc1)C1=Nc2ccccc2SC(C1)c1ccc2c(c1)OCO2
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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 C22H17NO2S MW 359.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17NO2S/c1-2-6-15(7-3-1)18-13-22(26-21-9-5-4-8-17(21)23-18)16-10-11-19-20(12-16)25-14-24-19/h1-12,22H,13-14H2InChIKey
GXFKHXXAXYNQBJ-UHFFFAOYSA-NSynonyms
2(13benzodioxol5yl)4phenyl23dihydro15benzothiazepine
2(13BENZODIOXOLE5YL)4PHENYL23DIHYDRO15BENZOTHIAZEPINE
2(2HBENZO(34D)13DIOXOLEN5YL)4PHENYL2H3HBENZO(B)14THIAZEPINE
C1C(SC2=CC=CC=C2N=C1C3=CC=CC=C3)C4=CC5=C(C=C4)OCO5
InChI=1SC22H17NO2Sc12615(731)181322(2621954817(21)2318)1610111920(1216)25142419h11222H1314H2
MFCD00370588
ZINC000005390941
ZINC000005390942
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