Vitas-M small molecule compound

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

Catalog ID
STK951282
SMILES Clc1ccc(cc1)N1OC2C(C1c1cccc(c1)[N+](=O)[O-])C(=O)N(C2=O)C(C)C

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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 C20H18ClN3O5 MW 415.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClN3O5/c1-11(2)22-19(25)16-17(12-4-3-5-15(10-12)24(27)28)23(29-18(16)20(22)26)14-8-6-13(21)7-9-14/h3-11,16-18H,1-2H3
InChIKey
NOMVSDQTOAIXOV-UHFFFAOYSA-N
Synonyms
1005053-10-0
1005053100
2(4chlorophenyl)3(3nitrophenyl)5(propan2yl)dihydro2Hpyrrolo(34d)(12)oxazole46(3H5H)dione
2(4CHLOROPHENYL)3(3NITROPHENYL)5PROPAN2YL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOLE46DIONE
2(4CHLOROPHENYL)5ISOPROPYL3(3NITROPHENYL)DIHYDRO2HPYRROLO(34D)ISOXAZOLE46(5H6AH)DIONE
CC(C)N1C(=O)C2C(N(OC2C1=O)C3=CC=C(C=C3)Cl)C4=CC(=CC=C4)(N+)(=O)(O)
Clc1ccc(cc1)N1OC2C(C1c1cccc(c1)(N+)(=O)(O))C(=O)N(C2=O)C(C)C
InChI=1SC20H18ClN3O5c111(2)2219(25)1617(1243515(1012)24(27)28)23(2918(16)20(22)26)148613(21)7914h3111618H12H3
MFCD02971027
ZINC000102864815
ZINC000245241713

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Available files

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