Vitas-M small molecule compound
N-[(2E)-6-{[4-(pyrimidin-2-yl)piperazin-1-yl]carbonyl}-1,3-benzothiazol-2(3H)-ylidene]methanesulfonamide
Catalog ID
STK627264
SMILES O=C(c1ccc2c(c1)s/c(=N/S(=O)(=O)C)/[nH]2)N1CCN(CC1)c1ncccn1
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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 C17H18N6O3S2 MW 418.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N6O3S2/c1-28(25,26)21-17-20-13-4-3-12(11-14(13)27-17)15(24)22-7-9-23(10-8-22)16-18-5-2-6-19-16/h2-6,11H,7-10H2,1H3,(H,20,21)InChIKey
XBRLYGJUAPFZKJ-UHFFFAOYSA-NSynonyms
951995-45-2951995452
CS(=O)(=O)NC1=NC2=C(S1)C=C(C=C2)C(=O)N3CCN(CC3)C4=NC=CC=N4
InChI=1SC17H18N6O3S2c128(2526)211720134312(1114(13)2717)15(24)227923(10822)16185261916h2611H710H21H3(H2021)
MFCD18159208
N((2E)6((4(pyrimidin2yl)piperazin1yl)carbonyl)13benzothiazol2(3H)ylidene)methanesulfonamide
N(6(4pyrimidin2ylpiperazine1carbonyl)13benzothiazol2yl)methanesulfonamide
O=C(c1ccc2c(c1)sc(=NS(=O)(=O)C)(nH)2)N1CCN(CC1)c1ncccn1
ZINC000013687228
ZINC13687228
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