Vitas-M small molecule compound

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

Catalog ID
STL338712
SMILES O=C1C2C(c3ccc(s3)c3ccc(cc3)[N+](=O)[O-])N(OC2C(=O)N1c1ccccc1)c1ccccc1

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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 C27H19N3O5S MW 497.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19N3O5S/c31-26-23-24(22-16-15-21(36-22)17-11-13-20(14-12-17)30(33)34)29(19-9-5-2-6-10-19)35-25(23)27(32)28(26)18-7-3-1-4-8-18/h1-16,23-25H
InChIKey
YAGSEIQCOXLKEW-UHFFFAOYSA-N
Synonyms
1022239-42-4
1022239424
3(5(4NITROPHENYL)THIOPHEN2YL)25DIPHENYL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOLE46DIONE
3(5(4nitrophenyl)thiophen2yl)25diphenyldihydro2Hpyrrolo(34d)(12)oxazole46(3H5H)dione
3(5(4NITROPHENYL)THIOPHEN2YL)25DIPHENYLDIHYDRO2HPYRROLO(34D)ISOXAZOLE46(3H5H)DIONE
3(5(4nitrophenyl)thiophen2yl)25diphenyldihydro2Hpyrrolo(34d)isoxazole46(5H6aH)dione
C1=CC=C(C=C1)N2C(C3C(O2)C(=O)N(C3=O)C4=CC=CC=C4)C5=CC=C(S5)C6=CC=C(C=C6)(N+)(=O)(O)
InChI=1SC27H19N3O5Sc31262324(22161521(3622)17111320(141217)30(33)34)29(1995261019)3525(23)27(32)28(26)187314818h1162325H
MFCD04005441
O=C1C2C(c3ccc(s3)c3ccc(cc3)(N+)(=O)(O))N(OC2C(=O)N1c1ccccc1)c1ccccc1
ZINC000009312434
ZINC000229867605

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Available files

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