Vitas-M small molecule compound
N-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
Catalog ID
STK636323
SMILES O=C(Nc1ccc2c(c1)OCO2)CNC(=O)c1ccc2c(c1)sc(n2)n1cccc1
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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 C21H16N4O4S MW 420.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N4O4S/c26-19(23-14-4-6-16-17(10-14)29-12-28-16)11-22-20(27)13-3-5-15-18(9-13)30-21(24-15)25-7-1-2-8-25/h1-10H,11-12H2,(H,22,27)(H,23,26)InChIKey
KSICCBATBNDJTH-UHFFFAOYSA-NSynonyms
1010900-92-11010900921
C1OC2=C(O1)C=C(C=C2)NC(=O)CNC(=O)C3=CC4=C(C=C3)N=C(S4)N5C=CC=C5
InChI=1SC21H16N4O4Sc2619(2314461617(1014)29122816)112220(27)13351518(913)3021(2415)25712825h110H1112H2(H2227)(H2326)
MFCD12204204
N(2(13benzodioxol5ylamino)2oxoethyl)2(1Hpyrrol1yl)13benzothiazole6carboxamide
N(2(13benzodioxol5ylamino)2oxoethyl)2pyrrol1yl13benzothiazole6carboxamide
N(2(benzo(d)(13)dioxol5ylamino)2oxoethyl)2(1Hpyrrol1yl)benzo(d)thiazole6carboxamide
ZINC000012408566
ZINC12408566
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