Vitas-M small molecule compound
N-(4-carbamoylphenyl)-2'-(2-methoxyethyl)-1'-oxo-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide
Catalog ID
STL157942
SMILES COCCN1C(=O)c2ccccc2C(C21CCCCC2)C(=O)Nc1ccc(cc1)C(=O)N
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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 C25H29N3O4 MW 435.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N3O4/c1-32-16-15-28-24(31)20-8-4-3-7-19(20)21(25(28)13-5-2-6-14-25)23(30)27-18-11-9-17(10-12-18)22(26)29/h3-4,7-12,21H,2,5-6,13-16H2,1H3,(H2,26,29)(H,27,30)InChIKey
MRYHALHCOUPZQA-UHFFFAOYSA-NSynonyms
1246038-41-41246038414
COCCN1C(=O)C2=CC=CC=C2C(C13CCCCC3)C(=O)NC4=CC=C(C=C4)C(=O)N
InChI=1SC25H29N3O4c13216152824(31)20843719(20)21(25(28)135261425)23(30)271811917(101218)22(26)29h3471221H2561316H21H3(H22629)(H2730)
MFCD20758185
N(4carbamoylphenyl)2(2methoxyethyl)1oxo14dihydro2Hspiro(cyclohexane13isoquinoline)4carboxamide
N(4carbamoylphenyl)2(2methoxyethyl)1oxo24dihydro1Hspiro(cyclohexane13isoquinoline)4carboxamide
N(4carbamoylphenyl)2(2methoxyethyl)1oxospiro(4Hisoquinoline31cyclohexane)4carboxamide
ZINC000049546995
ZINC000049546997
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