Vitas-M small molecule compound
N-{(2S)-1-[(1,3-benzodioxol-5-ylmethyl)amino]-1-oxopropan-2-yl}-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
Catalog ID
STK648655
SMILES O=C([C@@H](NC(=O)c1ccc2c(c1)sc(n2)n1cccc1)C)NCc1ccc2c(c1)OCO2
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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 C23H20N4O4S MW 448.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N4O4S/c1-14(21(28)24-12-15-4-7-18-19(10-15)31-13-30-18)25-22(29)16-5-6-17-20(11-16)32-23(26-17)27-8-2-3-9-27/h2-11,14H,12-13H2,1H3,(H,24,28)(H,25,29)/t14-/m0/s1InChIKey
AEOQFBLECIHYPH-AWEZNQCLSA-NSynonyms
1175835-75-2(S)N(1((benzo(d)(13)dioxol5ylmethyl)amino)1oxopropan2yl)2(1Hpyrrol1yl)benzo(d)thiazole6carboxamide
1175835752
CC(C(=O)NCC1=CC2=C(C=C1)OCO2)NC(=O)C3=CC4=C(C=C3)N=C(S4)N5C=CC=C5
InChI=1SC23H20N4O4Sc114(21(28)241215471819(1015)31133018)2522(29)16561720(1116)3223(2617)27823927h21114H1213H21H3(H2428)(H2529)t14m0s1
MFCD18164980
N((2S)1((13benzodioxol5ylmethyl)amino)1oxopropan2yl)2(1Hpyrrol1yl)13benzothiazole6carboxamide
N((2S)1(13benzodioxol5ylmethylamino)1oxopropan2yl)2pyrrol1yl13benzothiazole6carboxamide
O=C((C@@H)(NC(=O)c1ccc2c(c1)sc(n2)n1cccc1)C)NCc1ccc2c(c1)OCO2
ZINC000032088438
ZINC32088438
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