Vitas-M small molecule compound
N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[(4-methyl-5-phenyl-1H-imidazol-2-yl)sulfanyl]acetamide
Catalog ID
STK247003
SMILES O=C(Nc1cc2OCOc2cc1C(=O)C)CSc1nc(c([nH]1)c1ccccc1)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 C21H19N3O4S MW 409.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O4S/c1-12-20(14-6-4-3-5-7-14)24-21(22-12)29-10-19(26)23-16-9-18-17(27-11-28-18)8-15(16)13(2)25/h3-9H,10-11H2,1-2H3,(H,22,24)(H,23,26)InChIKey
BYVKLJAXLQUGNI-UHFFFAOYSA-NSynonyms
879035-08-2879035082
CC1=C(N=C(N1)SCC(=O)NC2=CC3=C(C=C2C(=O)C)OCO3)C4=CC=CC=C4
InChI=1SC21H19N3O4Sc11220(146435714)2421(2212)291019(26)231691817(27112818)815(16)13(2)25h39H1011H212H3(H2224)(H2326)
MFCD07402367
N(6ACETYL(2HBENZO(D)13DIOXOLAN5YL))2(4METHYL5PHENYLIMIDAZOL2YLTHIO)ACETAMIDE
N(6acetyl13benzodioxol5yl)2((4methyl5phenyl1Himidazol2yl)sulfanyl)acetamide
N(6ACETYL13BENZODIOXOL5YL)2((5METHYL4PHENYL1HIMIDAZOL2YL)SULFANYL)ACETAMIDE
O=C(Nc1cc2OCOc2cc1C(=O)C)CSc1nc(c((nH)1)c1ccccc1)C
ZINC000004945316
ZINC04945316
ZINC4945316
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