Vitas-M small molecule compound
Catalog ID
STK609536
SMILES CCC([C@@H](C(=O)OC)NC(=O)N1CCc2c(C1c1ccc(cc1)F)cc(c(c2)OC)OC)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 C25H31FN2O5 MW 458.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31FN2O5/c1-6-15(2)22(24(29)33-5)27-25(30)28-12-11-17-13-20(31-3)21(32-4)14-19(17)23(28)16-7-9-18(26)10-8-16/h7-10,13-15,22-23H,6,11-12H2,1-5H3,(H,27,30)/t15?,22-,23?/m0/s1InChIKey
MGZJCJCFNYPALO-UJRRCDGMSA-NSynonyms
957019-39-5(2S3R)methyl2(1(4fluorophenyl)67dimethoxy1234tetrahydroisoquinoline2carboxamido)3methylpentanoate
957019395
CCC((C@@H)(C(=O)OC)NC(=O)N1CCc2c(C1c1ccc(cc1)F)cc(c(c2)OC)OC)C
CCC(C)C(C(=O)OC)NC(=O)N1CCC2=CC(=C(C=C2C1C3=CC=C(C=C3)F)OC)OC
InChI=1SC25H31FN2O5c1615(2)22(24(29)335)2725(30)281211171320(313)21(324)1419(17)23(28)167918(26)10816h71013152223H61112H215H3(H2730)t15?2223?m0s1
methyl(2S)2((1(4fluorophenyl)67dimethoxy34dihydro1Hisoquinoline2carbonyl)amino)3methylpentanoate
ZINC000009435520
ZINC000013608842
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