Vitas-M small molecule compound

N-[3-(5-amino-1-methyl-1H-benzimidazol-2-yl)propyl]-2,3-dihydro-1,4-benzodioxine-2-carboxamide

Catalog ID
STK628953
SMILES O=C(C1COc2c(O1)cccc2)NCCCc1nc2c(n1C)ccc(c2)N

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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 C20H22N4O3 MW 366.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O3/c1-24-15-9-8-13(21)11-14(15)23-19(24)7-4-10-22-20(25)18-12-26-16-5-2-3-6-17(16)27-18/h2-3,5-6,8-9,11,18H,4,7,10,12,21H2,1H3,(H,22,25)
InChIKey
IUPUYLQMBLHLCI-UHFFFAOYSA-N
Synonyms
951972-74-0
951972740
CN1C2=C(C=C(C=C2)N)N=C1CCCNC(=O)C3COC4=CC=CC=C4O3
InChI=1SC20H22N4O3c124159813(21)1114(15)2319(24)74102220(25)18122616523617(16)2718h2356891118H47101221H21H3(H2225)
MFCD09858656
N(3(5amino1methyl1Hbenzimidazol2yl)propyl)23dihydro14benzodioxine2carboxamide
N(3(5amino1methyl1Hbenzo(d)imidazol2yl)propyl)23dihydrobenzo(b)(14)dioxine2carboxamide
N(3(5amino1methylbenzimidazol2yl)propyl)23dihydro14benzodioxine3carboxamide
ZINC000013734986
ZINC000013734989

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Available files

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