Vitas-M small molecule compound
N-{(2S)-1-[(2-methoxyphenyl)amino]-3-methyl-1-oxobutan-2-yl}-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
Catalog ID
STK634446
SMILES COc1ccccc1NC(=O)[C@H](C(C)C)NC(=O)c1ccc2c(c1)sc(n2)n1cccc1
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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 C24H24N4O3S MW 448.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24N4O3S/c1-15(2)21(23(30)25-17-8-4-5-9-19(17)31-3)27-22(29)16-10-11-18-20(14-16)32-24(26-18)28-12-6-7-13-28/h4-15,21H,1-3H3,(H,25,30)(H,27,29)/t21-/m0/s1InChIKey
XBBUJBYGJFHKOK-NRFANRHFSA-NSynonyms
1175749-69-5(S)N(1((2methoxyphenyl)amino)3methyl1oxobutan2yl)2(1Hpyrrol1yl)benzo(d)thiazole6carboxamide
1175749695
CC(C)C(C(=O)NC1=CC=CC=C1OC)NC(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4
COc1ccccc1NC(=O)(C@H)(C(C)C)NC(=O)c1ccc2c(c1)sc(n2)n1cccc1
InChI=1SC24H24N4O3Sc115(2)21(23(30)2517845919(17)313)2722(29)1610111820(1416)3224(2618)2812671328h41521H13H3(H2530)(H2729)t21m0s1
MFCD18160397
N((2S)1((2methoxyphenyl)amino)3methyl1oxobutan2yl)2(1Hpyrrol1yl)13benzothiazole6carboxamide
N((2S)1(2methoxyanilino)3methyl1oxobutan2yl)2pyrrol1yl13benzothiazole6carboxamide
ZINC000012321295
ZINC12321295
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