Vitas-M small molecule compound
N-(6-tert-butyl-3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1,3-benzodioxole-5-carboxamide
Catalog ID
STK234632
SMILES NC(=O)c1c(NC(=O)c2ccc3c(c2)OCO3)sc2c1CCC(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 C21H24N2O4S MW 400.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O4S/c1-21(2,3)12-5-6-13-16(9-12)28-20(17(13)18(22)24)23-19(25)11-4-7-14-15(8-11)27-10-26-14/h4,7-8,12H,5-6,9-10H2,1-3H3,(H2,22,24)(H,23,25)InChIKey
DMDAJNDYSBHISG-UHFFFAOYSA-NSynonyms
CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=CC4=C(C=C3)OCO4
InChI=1SC21H24N2O4Sc121(23)12561316(912)2820(17(13)18(22)24)2319(25)11471415(811)27102614h47812H56910H213H3(H22224)(H2325)
MFCD01342022
N(6tertbutyl3carbamoyl4567tetrahydro1benzothiophen2yl)13benzodioxole5carboxamide
ZINC000000995195
ZINC000000995196
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