Vitas-M small molecule compound

(2E)-3-(3-nitrophenyl)-N-[1-(1-pentyl-1H-benzimidazol-2-yl)ethyl]prop-2-enamide

Catalog ID
STK553029
SMILES CCCCCn1c(nc2c1cccc2)C(NC(=O)/C=C/c1cccc(c1)[N+](=O)[O-])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 C23H26N4O3 MW 406.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N4O3/c1-3-4-7-15-26-21-12-6-5-11-20(21)25-23(26)17(2)24-22(28)14-13-18-9-8-10-19(16-18)27(29)30/h5-6,8-14,16-17H,3-4,7,15H2,1-2H3,(H,24,28)/b14-13+
InChIKey
MBJAYMCLLZRZSL-BUHFOSPRSA-N
Synonyms
799783-29-2
(2E)3(3nitrophenyl)N(1(1pentyl1Hbenzimidazol2yl)ethyl)prop2enamide
(E)3(3nitrophenyl)N(1(1pentyl1Hbenzo(d)imidazol2yl)ethyl)acrylamide
(E)3(3NITROPHENYL)N(1(1PENTYLBENZIMIDAZOL2YL)ETHYL)PROP2ENAMIDE
799783292
CCCCCn1c(nc2c1cccc2)C(NC(=O)C=Cc1cccc(c1)(N+)(=O)(O))C
CCCCCN1C2=CC=CC=C2N=C1C(C)NC(=O)C=CC3=CC(=CC=C3)(N+)(=O)(O)
InChI=1SC23H26N4O3c134715262112651120(21)2523(26)17(2)2422(28)141318981019(1618)27(29)30h568141617H34715H212H3(H2428)b1413+
MFCD03674674
ZINC000013660544
ZINC000013660548

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Available files

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