Vitas-M small molecule compound

N-{[1-(propan-2-yl)-1H-benzimidazol-2-yl]methyl}-2,4,5,6,7,8-hexahydrocyclohepta[c]pyrazole-3-carboxamide

Catalog ID
STL407875
SMILES O=C(c1[nH]nc2c1CCCCC2)NCc1nc2c(n1C(C)C)cccc2

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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 C20H25N5O MW 351.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N5O/c1-13(2)25-17-11-7-6-10-16(17)22-18(25)12-21-20(26)19-14-8-4-3-5-9-15(14)23-24-19/h6-7,10-11,13H,3-5,8-9,12H2,1-2H3,(H,21,26)(H,23,24)
InChIKey
DITLUHOKZYEURV-UHFFFAOYSA-N
Synonyms
1574399-54-4
1574399544
CC(C)N1C2=CC=CC=C2N=C1CNC(=O)C3=NNC4=C3CCCCC4
InChI=1SC20H25N5Oc113(2)251711761016(17)2218(25)122120(26)19148435915(14)232419h67101113H358912H212H3(H2126)(H2324)
MFCD30704947
N((1(propan2yl)1Hbenzimidazol2yl)methyl)245678hexahydrocyclohepta(c)pyrazole3carboxamide
N((1isopropyl1Hbenzo(d)imidazol2yl)methyl)145678hexahydrocyclohepta(c)pyrazole3carboxamide
N((1propan2ylbenzimidazol2yl)methyl)145678hexahydrocyclohepta(c)pyrazole3carboxamide
O=C(c1(nH)nc2c1CCCCC2)NCc1nc2c(n1C(C)C)cccc2
O=C(c1n(nH)c2c1CCCCC2)NCc1nc2c(n1C(C)C)cccc2
ZINC000096232123
ZINC96232123

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Available files

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