Vitas-M small molecule compound
N-[3-(cyclopentylcarbamoyl)-1-ethyl-1H-pyrazol-4-yl]-2-(2,3-dihydro-1,4-benzodioxin-6-yl)quinoline-4-carboxamide
Catalog ID
STK447405
SMILES CCn1nc(c(c1)NC(=O)c1cc(nc2c1cccc2)c1ccc2c(c1)OCCO2)C(=O)NC1CCCC1
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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 C29H29N5O4 MW 511.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N5O4/c1-2-34-17-24(27(33-34)29(36)30-19-7-3-4-8-19)32-28(35)21-16-23(31-22-10-6-5-9-20(21)22)18-11-12-25-26(15-18)38-14-13-37-25/h5-6,9-12,15-17,19H,2-4,7-8,13-14H2,1H3,(H,30,36)(H,32,35)InChIKey
BNQZMLWOAGIGDQ-UHFFFAOYSA-NSynonyms
(4((2(2H3HBENZO(34E)14DIOXAN6YL)(4QUINOLYL))CARBONYLAMINO)1ETHYLPYRAZOL3YL)NCYCLOPENTYLCARBOXAMIDE
CCN1C=C(C(=N1)C(=O)NC2CCCC2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC6=C(C=C5)OCCO6
InChI=1SC29H29N5O4c12341724(27(3334)29(36)3019734819)3228(35)211623(31221065920(21)22)1811122526(1518)3814133725h56912151719H24781314H21H3(H3036)(H3235)
MFCD04059982
N(3(cyclopentylcarbamoyl)1ethyl1Hpyrazol4yl)2(23dihydro14benzodioxin6yl)quinoline4carboxamide
N(3(cyclopentylcarbamoyl)1ethylpyrazol4yl)2(23dihydro14benzodioxin6yl)quinoline4carboxamide
ZINC000020215241
ZINC20215241
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