Vitas-M small molecule compound
N-[(2E)-6-{[4-(3-methoxyphenyl)piperazin-1-yl]carbonyl}-1,3-benzothiazol-2(3H)-ylidene]methanesulfonamide
Catalog ID
STK633458
SMILES COc1cccc(c1)N1CCN(CC1)C(=O)c1ccc2c(c1)s/c(=N/S(=O)(=O)C)/[nH]2
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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 C20H22N4O4S2 MW 446.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O4S2/c1-28-16-5-3-4-15(13-16)23-8-10-24(11-9-23)19(25)14-6-7-17-18(12-14)29-20(21-17)22-30(2,26)27/h3-7,12-13H,8-11H2,1-2H3,(H,21,22)InChIKey
OCKQWCHZHSSXFH-UHFFFAOYSA-NSynonyms
951957-12-3951957123
COC1=CC=CC(=C1)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)N=C(S4)NS(=O)(=O)C
COc1cccc(c1)N1CCN(CC1)C(=O)c1ccc2c(c1)sc(=NS(=O)(=O)C)(nH)2
InChI=1SC20H22N4O4S2c1281653415(1316)2381024(11923)19(25)14671718(1214)2920(2117)2230(226)27h371213H811H212H3(H2122)
MFCD18160103
N((2E)6((4(3methoxyphenyl)piperazin1yl)carbonyl)13benzothiazol2(3H)ylidene)methanesulfonamide
N(6(4(3methoxyphenyl)piperazine1carbonyl)13benzothiazol2yl)methanesulfonamide
ZINC000013727810
ZINC13727810
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