Vitas-M small molecule compound
1'-[(Z)-2'H-spiro[cyclopentane-1,3'-isoquinolin]-1'(4'H)-ylidenemethyl]-4'H-spiro[cyclopentane-1,3'-isoquinoline]
Catalog ID
STK769722
SMILES c1ccc2c(c1)/C(=C/C1=NC3(CCCC3)Cc3c1cccc3)/NC1(C2)CCCC1
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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 C27H30N2 MW 382.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N2/c1-3-11-22-20(9-1)18-26(13-5-6-14-26)28-24(22)17-25-23-12-4-2-10-21(23)19-27(29-25)15-7-8-16-27/h1-4,9-12,17,28H,5-8,13-16,18-19H2/b24-17-InChIKey
MFORPTCQGVHPKK-ULJHMMPZSA-NSynonyms
1((Z)2Hspiro(cyclopentane13isoquinolin)1(4H)ylidenemethyl)4Hspiro(cyclopentane13isoquinoline)
1((Z)SPIRO(24DIHYDROISOQUINOLINE31CYCLOPENTANE)1YLIDENEMETHYL)SPIRO(4HISOQUINOLINE31CYCLOPENTANE)
1(SPIRO(234TRIHYDROISOQUINOLINE31CYCLOPENTANE)YLIDENEMETHYL)SPIRO(34DIHYDROISOQUINOLINE31CYCLOPENTANE)
C1CCC2(C1)CC3=CC=CC=C3C(=CC4=NC5(CCCC5)CC6=CC=CC=C64)N2
c1ccc2c(c1)C(=CC1=NC3(CCCC3)Cc3c1cccc3)NC1(C2)CCCC1
InChI=1SC27H30N2c13112220(91)1826(13561426)2824(22)17252312421021(23)1927(2925)15781627h149121728H5813161819H2b2417
MFCD03763541
ZINC000100122441
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