Vitas-M small molecule compound
5-amino-1-(3-hydroxy-2H-1,4-benzoxazin-7-yl)-4-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-1,2-dihydro-3H-pyrrol-3-one
Catalog ID
STL425490
SMILES COc1ccc(cc1)c1csc(n1)C1=C(N)N(CC1=O)c1ccc2c(c1)OCC(=N2)O
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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 C22H18N4O4S MW 434.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N4O4S/c1-29-14-5-2-12(3-6-14)16-11-31-22(25-16)20-17(27)9-26(21(20)23)13-4-7-15-18(8-13)30-10-19(28)24-15/h2-8,11H,9-10,23H2,1H3,(H,24,28)InChIKey
FNKCZZJXPUYPTH-UHFFFAOYSA-NSynonyms
5amino1(3hydroxy2H14benzoxazin7yl)4(4(4methoxyphenyl)13thiazol2yl)12dihydro3Hpyrrol3one
7(5amino4(4(4methoxyphenyl)13thiazol2yl)3oxo2Hpyrrol1yl)4H14benzoxazin3one
COC1=CC=C(C=C1)C2=CSC(=N2)C3=C(N(CC3=O)C4=CC5=C(C=C4)NC(=O)CO5)N
InChI=1SC22H18N4O4Sc129145212(3614)16113122(2516)2017(27)926(21(20)23)13471518(813)301019(28)2415h2811H91023H21H3(H2428)
MFCD30710017
ZINC000218175944
ZINC218175944
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