Vitas-M small molecule compound
6-[3-(4-benzylpiperazin-1-yl)-3-oxopropyl]-2,3,5-trimethyl-7H-furo[3,2-g]chromen-7-one
Catalog ID
STL226688
SMILES O=C(N1CCN(CC1)Cc1ccccc1)CCc1c(=O)oc2c(c1C)cc1c(c2)oc(c1C)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 C28H30N2O4 MW 458.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N2O4/c1-18-20(3)33-25-16-26-24(15-23(18)25)19(2)22(28(32)34-26)9-10-27(31)30-13-11-29(12-14-30)17-21-7-5-4-6-8-21/h4-8,15-16H,9-14,17H2,1-3H3InChIKey
IUSPJYNMYHIRJR-UHFFFAOYSA-NSynonyms
929837-07-06(3(4benzylpiperazin1yl)3oxopropyl)235trimethyl7Hfuro(32g)chromen7one
6(3(4benzylpiperazin1yl)3oxopropyl)235trimethylfuro(32g)chromen7one
929837070
CC1=C(OC2=C1C=C3C(=C(C(=O)OC3=C2)CCC(=O)N4CCN(CC4)CC5=CC=CC=C5)C)C
InChI=1SC28H30N2O4c11820(3)3325162624(1523(18)25)19(2)22(28(32)3426)91027(31)30131129(121430)17217546821h481516H91417H213H3
MFCD09848383
ZINC000020650055
ZINC20650055
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