Vitas-M small molecule compound
N-[(2S)-3-methyl-1-oxo-1-(thiomorpholin-4-yl)pentan-2-yl]-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
Catalog ID
STK658321
SMILES CC[C@@H]([C@@H](C(=O)N1CCSCC1)NC(=O)c1ccc2c(c1)sc(n2)n1cccc1)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 C22H26N4O2S2 MW 442.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4O2S2/c1-3-15(2)19(21(28)25-10-12-29-13-11-25)24-20(27)16-6-7-17-18(14-16)30-22(23-17)26-8-4-5-9-26/h4-9,14-15,19H,3,10-13H2,1-2H3,(H,24,27)/t15-,19-/m0/s1InChIKey
SXLUDOXHUCJRIV-KXBFYZLASA-NSynonyms
1176557-76-81176557768
CC(C@@H)((C@@H)(C(=O)N1CCSCC1)NC(=O)c1ccc2c(c1)sc(n2)n1cccc1)C
CCC(C)C(C(=O)N1CCSCC1)NC(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4
InChI=1SC22H26N4O2S2c1315(2)19(21(28)25101229131125)2420(27)16671718(1416)3022(2317)26845926h49141519H31013H212H3(H2427)t1519m0s1
MFCD18168340
N((2S)3methyl1oxo1(thiomorpholin4yl)pentan2yl)2(1Hpyrrol1yl)13benzothiazole6carboxamide
N((2S3S)3methyl1oxo1thiomorpholin4ylpentan2yl)2pyrrol1yl13benzothiazole6carboxamide
N((2S3S)3methyl1oxo1thiomorpholinopentan2yl)2(1Hpyrrol1yl)benzo(d)thiazole6carboxamide
ZINC000032096549
ZINC32096549
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