Vitas-M small molecule compound
N-{1-[1-(2-methoxyethyl)-1H-benzimidazol-2-yl]ethyl}-2,4,5,6,7,8-hexahydrocyclohepta[c]pyrazole-3-carboxamide
Catalog ID
STL425306
SMILES COCCn1c(nc2c1cccc2)C(NC(=O)c1[nH]nc2c1CCCCC2)C
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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 C21H27N5O2 MW 381.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N5O2/c1-14(20-23-17-10-6-7-11-18(17)26(20)12-13-28-2)22-21(27)19-15-8-4-3-5-9-16(15)24-25-19/h6-7,10-11,14H,3-5,8-9,12-13H2,1-2H3,(H,22,27)(H,24,25)InChIKey
QFMJQEQYMDGGQK-UHFFFAOYSA-NSynonyms
(S)N(1(1(2methoxyethyl)1Hbenzo(d)imidazol2yl)ethyl)145678hexahydrocyclohepta(c)pyrazole3carboxamide
CC(C1=NC2=CC=CC=C2N1CCOC)NC(=O)C3=NNC4=C3CCCCC4
COCCn1c(nc2c1cccc2)(C@@H)(NC(=O)c1n(nH)c2c1CCCCC2)C
COCCn1c(nc2c1cccc2)C(NC(=O)c1(nH)nc2c1CCCCC2)C
InChI=1SC21H27N5O2c114(20231710671118(17)26(20)1213282)2221(27)19158435916(15)242519h67101114H35891213H212H3(H2227)(H2425)
MFCD30709898
N(1(1(2methoxyethyl)1Hbenzimidazol2yl)ethyl)245678hexahydrocyclohepta(c)pyrazole3carboxamide
N(1(1(2methoxyethyl)benzimidazol2yl)ethyl)145678hexahydrocyclohepta(c)pyrazole3carboxamide
ZINC000218229504
ZINC000252497390
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