Vitas-M small molecule compound
N-[3-(acetylamino)phenyl]-2'-(2-methylpropyl)-1'-oxo-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide
Catalog ID
STL250389
SMILES CC(CN1C(=O)c2ccccc2C(C21CCCCC2)C(=O)Nc1cccc(c1)NC(=O)C)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 C27H33N3O3 MW 447.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H33N3O3/c1-18(2)17-30-26(33)23-13-6-5-12-22(23)24(27(30)14-7-4-8-15-27)25(32)29-21-11-9-10-20(16-21)28-19(3)31/h5-6,9-13,16,18,24H,4,7-8,14-15,17H2,1-3H3,(H,28,31)(H,29,32)InChIKey
CWTCFINBUZGNPC-UHFFFAOYSA-NSynonyms
1323955-04-91323955049
CC(C)CN1C(=O)C2=CC=CC=C2C(C13CCCCC3)C(=O)NC4=CC(=CC=C4)NC(=O)C
InChI=1SC27H33N3O3c118(2)173026(33)2313651222(23)24(27(30)147481527)25(32)29211191020(1621)2819(3)31h56913161824H478141517H213H3(H2831)(H2932)
MFCD24852334
N(3(acetylamino)phenyl)2(2methylpropyl)1oxo14dihydro2Hspiro(cyclohexane13isoquinoline)4carboxamide
N(3acetamidophenyl)2(2methylpropyl)1oxospiro(4Hisoquinoline31cyclohexane)4carboxamide
N(3acetamidophenyl)2isobutyl1oxo24dihydro1Hspiro(cyclohexane13isoquinoline)4carboxamide
ZINC000071284744
ZINC000071284745
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