Vitas-M small molecule compound

N-{3-[2-(morpholin-4-yl)ethoxy]phenyl}-2,4,5,6,7,8-hexahydrocyclohepta[c]pyrazole-3-carboxamide

Catalog ID
STL493336
SMILES O=C(c1[nH]nc2c1CCCCC2)Nc1cccc(c1)OCCN1CCOCC1

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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 C21H28N4O3 MW 384.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N4O3/c26-21(20-18-7-2-1-3-8-19(18)23-24-20)22-16-5-4-6-17(15-16)28-14-11-25-9-12-27-13-10-25/h4-6,15H,1-3,7-14H2,(H,22,26)(H,23,24)
InChIKey
LOVLMLYPUAESBS-UHFFFAOYSA-N
Synonyms

C1CCC2=C(CC1)NN=C2C(=O)NC3=CC(=CC=C3)OCCN4CCOCC4
InChI=1SC21H28N4O3c2621(20187213819(18)232420)221654617(1516)2814112591227131025h4615H13714H2(H2226)(H2324)
MFCD30715715
N(3(2(morpholin4yl)ethoxy)phenyl)245678hexahydrocyclohepta(c)pyrazole3carboxamide
N(3(2morpholin4ylethoxy)phenyl)145678hexahydrocyclohepta(c)pyrazole3carboxamide
N(3(2morpholinoethoxy)phenyl)145678hexahydrocyclohepta(c)pyrazole3carboxamide
O=C(c1(nH)nc2c1CCCCC2)Nc1cccc(c1)OCCN1CCOCC1
O=C(c1n(nH)c2c1CCCCC2)Nc1cccc(c1)OCCN1CCOCC1
ZINC000257263198

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Available files

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