Vitas-M small molecule compound
N-[3-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]-3-nitro-4-(piperidin-1-yl)benzamide
Catalog ID
STK243594
SMILES O=C(c1ccc(c(c1)[N+](=O)[O-])N1CCCCC1)Nc1cccc(c1)c1sc2n(n1)c(nn2)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 C22H21N7O3S MW 463.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N7O3S/c1-14-24-25-22-28(14)26-21(33-22)16-6-5-7-17(12-16)23-20(30)15-8-9-18(19(13-15)29(31)32)27-10-3-2-4-11-27/h5-9,12-13H,2-4,10-11H2,1H3,(H,23,30)InChIKey
HMXAURUIGAQHRS-UHFFFAOYSA-NSynonyms
CC1=NN=C2N1N=C(S2)C3=CC(=CC=C3)NC(=O)C4=CC(=C(C=C4)N5CCCCC5)(N+)(=O)(O)
InChI=1SC22H21N7O3Sc11424252228(14)2621(3322)1665717(1216)2320(30)158918(19(1315)29(31)32)27103241127h591213H241011H21H3(H2330)
MFCD05810683
N(3(3methyl(124)triazolo(34b)(134)thiadiazol6yl)phenyl)3nitro4(piperidin1yl)benzamide
N(3(3METHYL(124)TRIAZOLO(34B)(134)THIADIAZOL6YL)PHENYL)3NITRO4PIPERIDIN1YLBENZAMIDE
O=C(c1ccc(c(c1)(N+)(=O)(O))N1CCCCC1)Nc1cccc(c1)c1sc2n(n1)c(nn2)C
ZINC000009192625
ZINC09192625
ZINC9192625
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