Vitas-M small molecule compound
6-tert-butyl-2-{[(2-methoxy-3-methylphenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STL089185
SMILES COc1c(C)cccc1C(=O)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 C22H28N2O3S MW 400.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N2O3S/c1-12-7-6-8-15(18(12)27-5)20(26)24-21-17(19(23)25)14-10-9-13(22(2,3)4)11-16(14)28-21/h6-8,13H,9-11H2,1-5H3,(H2,23,25)(H,24,26)InChIKey
SBLUQQOTYLRITB-UHFFFAOYSA-NSynonyms
6tertbutyl2(((2methoxy3methylphenyl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxamide
6tertbutyl2((2methoxy3methylbenzoyl)amino)4567tetrahydro1benzothiophene3carboxamide
CC1=CC=CC(=C1OC)C(=O)NC2=C(C3=C(S2)CC(CC3)C(C)(C)C)C(=O)N
InChI=1SC22H28N2O3Sc11276815(18(12)275)20(26)242117(19(23)25)1410913(22(23)4)1116(14)2821h6813H911H215H3(H22325)(H2426)
MFCD14857120
ZINC000041091655
ZINC000041091656
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