Vitas-M small molecule compound
2'-butyl-N-(4-carbamoylphenyl)-1'-oxo-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide
Catalog ID
STL155175
SMILES CCCCN1C(=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 C26H31N3O3 MW 433.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31N3O3/c1-2-3-17-29-25(32)21-10-6-5-9-20(21)22(26(29)15-7-4-8-16-26)24(31)28-19-13-11-18(12-14-19)23(27)30/h5-6,9-14,22H,2-4,7-8,15-17H2,1H3,(H2,27,30)(H,28,31)InChIKey
DKJMYNKAQLLELO-UHFFFAOYSA-NSynonyms
1310930-71-21310930712
2butylN(4carbamoylphenyl)1oxo14dihydro2Hspiro(cyclohexane13isoquinoline)4carboxamide
2butylN(4carbamoylphenyl)1oxo24dihydro1Hspiro(cyclohexane13isoquinoline)4carboxamide
2butylN(4carbamoylphenyl)1oxospiro(4Hisoquinoline31cyclohexane)4carboxamide
CCCCN1C(=O)C2=CC=CC=C2C(C13CCCCC3)C(=O)NC4=CC=C(C=C4)C(=O)N
InChI=1SC26H31N3O3c123172925(32)211065920(21)22(26(29)157481626)24(31)2819131118(121419)23(27)30h5691422H24781517H21H3(H22730)(H2831)
MFCD20757219
ZINC000071283290
ZINC000071283291
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