Vitas-M small molecule compound
N-[(2E)-6-{[4-(2,3-dihydro-1,4-benzodioxin-2-ylcarbonyl)piperazin-1-yl]carbonyl}-1,3-benzothiazol-2(3H)-ylidene]acetamide
Catalog ID
STK647263
SMILES CC(=O)/N=c/1\[nH]c2c(s1)cc(cc2)C(=O)N1CCN(CC1)C(=O)C1COc2c(O1)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 C23H22N4O5S MW 466.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O5S/c1-14(28)24-23-25-16-7-6-15(12-20(16)33-23)21(29)26-8-10-27(11-9-26)22(30)19-13-31-17-4-2-3-5-18(17)32-19/h2-7,12,19H,8-11,13H2,1H3,(H,24,25,28)InChIKey
KPUFDUDCEUVZAD-UHFFFAOYSA-NSynonyms
951937-97-6951937976
CC(=O)N=c1(nH)c2c(s1)cc(cc2)C(=O)N1CCN(CC1)C(=O)C1COc2c(O1)cccc2
CC(=O)NC1=NC2=C(S1)C=C(C=C2)C(=O)N3CCN(CC3)C(=O)C4COC5=CC=CC=C5O4
InChI=1SC23H22N4O5Sc114(28)242325167615(1220(16)3323)21(29)2681027(11926)22(30)19133117423518(17)3219h271219H81113H21H3(H242528)
MFCD18164510
N((2E)6((4(23dihydro14benzodioxin2ylcarbonyl)piperazin1yl)carbonyl)13benzothiazol2(3H)ylidene)acetamide
N(6(4(23dihydro14benzodioxine3carbonyl)piperazine1carbonyl)13benzothiazol2yl)acetamide
ZINC000013721032
ZINC000013721035
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