Vitas-M small molecule compound

N-{(1Z)-3-(tert-butylamino)-1-[5-(3-nitrophenyl)furan-2-yl]-3-oxoprop-1-en-2-yl}-4-methylbenzamide

Catalog ID
STL200489
SMILES Cc1ccc(cc1)C(=O)N/C(=C\c1ccc(o1)c1cccc(c1)[N+](=O)[O-])/C(=O)NC(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 C25H25N3O5 MW 447.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O5/c1-16-8-10-17(11-9-16)23(29)26-21(24(30)27-25(2,3)4)15-20-12-13-22(33-20)18-6-5-7-19(14-18)28(31)32/h5-15H,1-4H3,(H,26,29)(H,27,30)/b21-15-
InChIKey
WGXNPTNIXGROQI-QNGOZBTKSA-N
Synonyms
1164503-98-3
(2Z)N(TERTBUTYL)2((4METHYLPHENYL)CARBONYLAMINO)3(5(3NITROPHENYL)(2FURYL))PROP2ENAMIDE
(Z)N(3(tertbutylamino)1(5(3nitrophenyl)furan2yl)3oxoprop1en2yl)4methylbenzamide
1164503983
CC1=CC=C(C=C1)C(=O)NC(=CC2=CC=C(O2)C3=CC(=CC=C3)(N+)(=O)(O))C(=O)NC(C)(C)C
Cc1ccc(cc1)C(=O)NC(=Cc1ccc(o1)c1cccc(c1)(N+)(=O)(O))C(=O)NC(C)(C)C
InChI=1SC25H25N3O5c11681017(11916)23(29)2621(24(30)2725(23)4)1520121322(3320)1865719(1418)28(31)32h515H14H3(H2629)(H2730)b2115
MFCD03283896
N((1Z)3(tertbutylamino)1(5(3nitrophenyl)furan2yl)3oxoprop1en2yl)4methylbenzamide
N((Z)1TERTBUTYLCARBAMOYL2(5(3NITROPHENYL)FURAN2YL)VINYL)4METHYLBENZAMIDE
N((Z)3(TERTBUTYLAMINO)1(5(3NITROPHENYL)FURAN2YL)3OXOPROP1EN2YL)4METHYLBENZAMIDE
ZINC000008691493
ZINC08691493
ZINC8691493

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Available files

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