Vitas-M small molecule compound
1'-[(Z)-(3,3-dimethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)methyl]-4'H-spiro[cyclohexane-1,3'-isoquinoline]
Catalog ID
STK028741
SMILES CC1(C)N/C(=C\C2=NC3(CCCCC3)Cc3c2cccc3)/c2c(C1)cccc2
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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 C26H30N2 MW 370.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N2/c1-25(2)17-19-10-4-6-12-21(19)23(27-25)16-24-22-13-7-5-11-20(22)18-26(28-24)14-8-3-9-15-26/h4-7,10-13,16,27H,3,8-9,14-15,17-18H2,1-2H3/b23-16-InChIKey
BOFXCSVGZDDUQH-KQWNVCNZSA-NSynonyms
1((Z)(33DIMETHYL24DIHYDROISOQUINOLIN1YLIDENE)METHYL)SPIRO(4HISOQUINOLINE31CYCLOHEXANE)
1((Z)(33DIMETHYL34DIHYDROISOQUINOLIN1(2H)YLIDENE)METHYL)4HSPIRO(CYCLOHEXANE13ISOQUINOLINE)
CC1(C)NC(=CC2=NC3(CCCCC3)Cc3c2cccc3)c2c(C1)cccc2
CC1(CC2=CC=CC=C2C(=CC3=NC4(CCCCC4)CC5=CC=CC=C53)N1)C
InChI=1SC26H30N2c125(2)171910461221(19)23(2725)16242213751120(22)1826(2824)148391526h4710131627H38914151718H212H3b2316
MFCD03059243
STK028741
ZINC000102459779
ZINC102459779
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