Vitas-M small molecule compound

2-(2-methylphenyl)-5-(3-nitrophenyl)-3-(thiophen-2-yl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione

Catalog ID
STL020366
SMILES O=C1N(c2cccc(c2)[N+](=O)[O-])C(=O)C2C1ON(C2c1cccs1)c1ccccc1C

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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 C22H17N3O5S MW 435.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O5S/c1-13-6-2-3-9-16(13)24-19(17-10-5-11-31-17)18-20(30-24)22(27)23(21(18)26)14-7-4-8-15(12-14)25(28)29/h2-12,18-20H,1H3
InChIKey
OCTBGNLBMWPCNX-UHFFFAOYSA-N
Synonyms
433261-69-9
2(2methylphenyl)5(3nitrophenyl)3(thiophen2yl)dihydro2Hpyrrolo(34d)(12)oxazole46(3H5H)dione
2(2METHYLPHENYL)5(3NITROPHENYL)3THIOPHEN2YL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOLE46DIONE
433261699
5(3NITROPHENYL)3(THIOPHEN2YL)2(OTOLYL)DIHYDRO2HPYRROLO(34D)ISOXAZOLE46(5H6AH)DIONE
CC1=CC=CC=C1N2C(C3C(O2)C(=O)N(C3=O)C4=CC(=CC=C4)(N+)(=O)(O))C5=CC=CS5
InChI=1SC22H17N3O5Sc113623916(13)2419(17105113117)1820(3024)22(27)23(21(18)26)1474815(1214)25(28)29h2121820H1H3
MFCD02971227
O=C1N(c2cccc(c2)(N+)(=O)(O))C(=O)C2C1ON(C2c1cccs1)c1ccccc1C
ZINC000101880184
ZINC000239377810

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Available files

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