Vitas-M small molecule compound

4-(5-amino-9-hydroxy-1,3,6-trioxo-3,3a,11b,11c-tetrahydro-6H-chromeno[4',3':4,5]thiopyrano[2,3-c]pyrrol-2(1H)-yl)-N-methylbenzamide

Catalog ID
STL312346
SMILES CNC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C1C(=C(S2)N)C(=O)Oc2c1ccc(c2)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 C22H17N3O6S MW 451.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O6S/c1-24-19(27)9-2-4-10(5-3-9)25-20(28)15-14-12-7-6-11(26)8-13(12)31-22(30)16(14)18(23)32-17(15)21(25)29/h2-8,14-15,17,26H,23H2,1H3,(H,24,27)
InChIKey
VNUCRUYLVNNXTM-UHFFFAOYSA-N
Synonyms
1436001-21-6
1436001216
4(5amino9hydroxy136trioxo33a11b11ctetrahydro6Hchromeno(4345)thiopyrano(23c)pyrrol2(1H)yl)Nmethylbenzamide
4(5amino9hydroxy136trioxo33adihydro1Hchromeno(4345)thiopyrano(23c)pyrrol2(6H11bH11cH)yl)Nmethylbenzamide
CNC(=O)C1=CC=C(C=C1)N2C(=O)C3C4C5=C(C=C(C=C5)O)OC(=O)C4=C(SC3C2=O)N
InChI=1SC22H17N3O6Sc12419(27)92410(539)2520(28)1514127611(26)813(12)3122(30)16(14)18(23)3217(15)21(25)29h2814151726H23H21H3(H2427)
MFCD23137896
ZINC000107425872
ZINC000245312519

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Available files

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