Vitas-M small molecule compound

1,1'-hexane-1,6-diylbis[3-(1H-1,2,4-triazol-3-yl)urea]

Catalog ID
STK369742
SMILES O=C(Nc1n[nH]cn1)NCCCCCCNC(=O)Nc1n[nH]cn1

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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 C12H20N10O2 MW 336.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H20N10O2/c23-11(19-9-15-7-17-21-9)13-5-3-1-2-4-6-14-12(24)20-10-16-8-18-22-10/h7-8H,1-6H2,(H3,13,15,17,19,21,23)(H3,14,16,18,20,22,24)
InChIKey
JCAWUVQEJLEQRS-UHFFFAOYSA-N
Synonyms
55424-85-6
(1H124TRIAZOL3YLAMINO)N(6((1H124TRIAZOL3YLAMINO)CARBONYLAMINO)HEXYL)CARBOXAMIDE
1(1H124TRIAZOL5YL)3(6(1H124TRIAZOL5YLCARBAMOYLAMINO)HEXYL)UREA
11hexane16diylbis(3(1H124triazol3yl)urea)
11HEXANE16DIYLBIS(3(1H124TRIAZOL5YL)UREA)
55424856
C1=NNC(=N1)NC(=O)NCCCCCCNC(=O)NC2=NC=NN2
InChI=1SC12H20N10O2c2311(19915717219)135312461412(24)2010168182210h78H16H2(H3131517192123)(H3141618202224)
MFCD00383296
O=C(Nc1n(nH)cn1)NCCCCCCNC(=O)Nc1n(nH)cn1
UREANN16HEXANEDIYLBIS(N1H124TRIAZOL3YL
ZINC000016382913
ZINC16382913

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Available files

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