Vitas-M small molecule compound
2'-cyclohexyl-1'-oxo-N-(pyridin-2-ylmethyl)-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide
Catalog ID
STL316186
SMILES O=C(C1c2ccccc2C(=O)N(C21CCCCC2)C1CCCCC1)NCc1ccccn1
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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 C27H33N3O2 MW 431.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H33N3O2/c31-25(29-19-20-11-7-10-18-28-20)24-22-14-5-6-15-23(22)26(32)30(21-12-3-1-4-13-21)27(24)16-8-2-9-17-27/h5-7,10-11,14-15,18,21,24H,1-4,8-9,12-13,16-17,19H2,(H,29,31)InChIKey
NXRLBAKKNSFKGU-UHFFFAOYSA-NSynonyms
1401529-27-81401529278
2cyclohexyl1oxoN(pyridin2ylmethyl)14dihydro2Hspiro(cyclohexane13isoquinoline)4carboxamide
2cyclohexyl1oxoN(pyridin2ylmethyl)24dihydro1Hspiro(cyclohexane13isoquinoline)4carboxamide
2cyclohexyl1oxoN(pyridin2ylmethyl)spiro(4Hisoquinoline31cyclohexane)4carboxamide
C1CCC(CC1)N2C(=O)C3=CC=CC=C3C(C24CCCCC4)C(=O)NCC5=CC=CC=N5
InChI=1SC27H33N3O2c3125(29192011710182820)242214561523(22)26(32)30(21123141321)27(24)168291727h5710111415182124H14891213161719H2(H2931)
MFCD28027673
ZINC000079484497
ZINC000079484500
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