Vitas-M small molecule compound
N-[5-(4-bromobenzyl)-1,3-thiazol-2-yl]-3-methyl-1-oxo-3,4-dihydro-1H-isochromene-3-carboxamide
Catalog ID
STL019026
SMILES Brc1ccc(cc1)Cc1cnc(s1)NC(=O)C1(C)OC(=O)c2c(C1)cccc2
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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 C21H17BrN2O3S MW 457.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17BrN2O3S/c1-21(11-14-4-2-3-5-17(14)18(25)27-21)19(26)24-20-23-12-16(28-20)10-13-6-8-15(22)9-7-13/h2-9,12H,10-11H2,1H3,(H,23,24,26)InChIKey
UEUYITMCLOHUQI-UHFFFAOYSA-NSynonyms
708250-52-6708250526
CC1(CC2=CC=CC=C2C(=O)O1)C(=O)NC3=NC=C(S3)CC4=CC=C(C=C4)Br
InChI=1SC21H17BrN2O3Sc121(1114423517(14)18(25)2721)19(26)2420231216(2820)10136815(22)9713h2912H1011H21H3(H232426)
MFCD04190597
N(5((4BROMOPHENYL)METHYL)(13THIAZOL2YL))(3METHYL1OXOISOCHROMAN3YL)CARBOXAMIDE
N(5((4BROMOPHENYL)METHYL)13THIAZOL2YL)3METHYL1OXO4HISOCHROMENE3CARBOXAMIDE
N(5(4bromobenzyl)13thiazol2yl)3methyl1oxo34dihydro1Hisochromene3carboxamide
N(5(4BROMOBENZYL)THIAZOL2YL)3METHYL1OXOISOCHROMAN3CARBOXAMIDE
ZINC000002709914
ZINC000008611592
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