Vitas-M small molecule compound
N-(6-tert-butyl-3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Catalog ID
STK498769
SMILES O=C(c1ccc2c(c1)OCCO2)Nc1sc2c(c1C(=O)N)CCC(C2)C(C)(C)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 C22H26N2O4S MW 414.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O4S/c1-22(2,3)13-5-6-14-17(11-13)29-21(18(14)19(23)25)24-20(26)12-4-7-15-16(10-12)28-9-8-27-15/h4,7,10,13H,5-6,8-9,11H2,1-3H3,(H2,23,25)(H,24,26)InChIKey
AZESMYIBTHTJTI-UHFFFAOYSA-NSynonyms
CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=CC4=C(C=C3)OCCO4
InChI=1SC22H26N2O4Sc122(23)13561417(1113)2921(18(14)19(23)25)2420(26)12471516(1012)28982715h471013H568911H213H3(H22325)(H2426)
MFCD04420706
N(6tertbutyl3carbamoyl4567tetrahydro1benzothiophen2yl)23dihydro14benzodioxine6carboxamide
ZINC000004821028
ZINC000004821029
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