Vitas-M small molecule compound

N-(1-methyl-2-{2-[4-(4-methylphenyl)piperazin-1-yl]ethyl}-1H-benzimidazol-5-yl)-2-(4-nitrophenoxy)acetamide

Catalog ID
STK796418
SMILES O=C(Nc1ccc2c(c1)nc(n2C)CCN1CCN(CC1)c1ccc(cc1)C)COc1ccc(cc1)[N+](=O)[O-]

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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 C29H32N6O4 MW 528.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N6O4/c1-21-3-6-23(7-4-21)34-17-15-33(16-18-34)14-13-28-31-26-19-22(5-12-27(26)32(28)2)30-29(36)20-39-25-10-8-24(9-11-25)35(37)38/h3-12,19H,13-18,20H2,1-2H3,(H,30,36)
InChIKey
XCNDHMIRFHKOHJ-UHFFFAOYSA-N
Synonyms
879445-30-4
879445304
CC1=CC=C(C=C1)N2CCN(CC2)CCC3=NC4=C(N3C)C=CC(=C4)NC(=O)COC5=CC=C(C=C5)(N+)(=O)(O)
InChI=1SC29H32N6O4c1213623(7421)34171533(161834)14132831261922(51227(26)32(28)2)3029(36)20392510824(91125)35(37)38h31219H131820H212H3(H3036)
MFCD06604120
N(1methyl2(2(4(4methylphenyl)piperazin1yl)ethyl)1Hbenzimidazol5yl)2(4nitrophenoxy)acetamide
N(1METHYL2(2(4(4METHYLPHENYL)PIPERAZIN1YL)ETHYL)BENZIMIDAZOL5YL)2(4NITROPHENOXY)ACETAMIDE
N(1methyl2(2(4(ptolyl)piperazin1yl)ethyl)1Hbenzo(d)imidazol5yl)2(4nitrophenoxy)acetamide
O=C(Nc1ccc2c(c1)nc(n2C)CCN1CCN(CC1)c1ccc(cc1)C)COc1ccc(cc1)(N+)(=O)(O)
ZINC000009110451
ZINC9110451

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Available files

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