Vitas-M small molecule compound
N-(2-{[2-(butylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-4-methylbenzamide
Catalog ID
STK724182
SMILES CCCCNC(=O)CSc1sc2c(n1)ccc(c2)NC(=O)c1ccc(cc1)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 C21H23N3O2S2 MW 413.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O2S2/c1-3-4-11-22-19(25)13-27-21-24-17-10-9-16(12-18(17)28-21)23-20(26)15-7-5-14(2)6-8-15/h5-10,12H,3-4,11,13H2,1-2H3,(H,22,25)(H,23,26)InChIKey
ZGVDAISAZIMUOY-UHFFFAOYSA-NSynonyms
CCCCNC(=O)CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)C
InChI=1SC21H23N3O2S2c134112219(25)132721241710916(1218(17)2821)2320(26)157514(2)6815h51012H341113H212H3(H2225)(H2326)
MFCD01239671
N(2((2(BUTYLAMINO)2OXOETHYL)SULFANYL)13BENZOTHIAZOL6YL)4METHYLBENZAMIDE
N(2(2(BUTYLAMINO)2OXOETHYL)SULFANYL13BENZOTHIAZOL6YL)4METHYLBENZAMIDE
ZINC000003664673
ZINC03664673
ZINC3664673
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