Vitas-M small molecule compound

N-{(1Z)-3-{[3-(1H-imidazol-1-yl)propyl]amino}-1-[5-(3-nitrophenyl)furan-2-yl]-3-oxoprop-1-en-2-yl}-4-methylbenzamide

Catalog ID
STK983052
SMILES Cc1ccc(cc1)C(=O)N/C(=C\c1ccc(o1)c1cccc(c1)[N+](=O)[O-])/C(=O)NCCCn1cncc1

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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 C27H25N5O5 MW 499.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N5O5/c1-19-6-8-20(9-7-19)26(33)30-24(27(34)29-12-3-14-31-15-13-28-18-31)17-23-10-11-25(37-23)21-4-2-5-22(16-21)32(35)36/h2,4-11,13,15-18H,3,12,14H2,1H3,(H,29,34)(H,30,33)/b24-17-
InChIKey
WXEOUWJYHUMNBO-ULJHMMPZSA-N
Synonyms
935550-75-7
(2Z)N(3IMIDAZOLYLPROPYL)2((4METHYLPHENYL)CARBONYLAMINO)3(5(3NITROPHENYL)(2FURYL))PROP2ENAMIDE
(Z)N(3((3(1Himidazol1yl)propyl)amino)1(5(3nitrophenyl)furan2yl)3oxoprop1en2yl)4methylbenzamide
935550757
CC1=CC=C(C=C1)C(=O)NC(=CC2=CC=C(O2)C3=CC(=CC=C3)(N+)(=O)(O))C(=O)NCCCN4C=CN=C4
Cc1ccc(cc1)C(=O)NC(=Cc1ccc(o1)c1cccc(c1)(N+)(=O)(O))C(=O)NCCCn1cncc1
InChI=1SC27H25N5O5c1196820(9719)26(33)3024(27(34)2912314311513281831)1723101125(3723)2142522(1621)32(35)36h2411131518H31214H21H3(H2934)(H3033)b2417
MFCD03284326
N((1Z)3((3(1Himidazol1yl)propyl)amino)1(5(3nitrophenyl)furan2yl)3oxoprop1en2yl)4methylbenzamide
N((Z)3(3IMIDAZOL1YLPROPYLAMINO)1(5(3NITROPHENYL)FURAN2YL)3OXOPROP1EN2YL)4METHYLBENZAMIDE
ZINC000008817851
ZINC08817851
ZINC8817851

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Available files

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