Vitas-M small molecule compound
ethyl 1-benzyl-5-(2-hydroxy-3-{4-[(4-methylphenyl)sulfonyl]piperazin-1-yl}propoxy)-2-methyl-1H-indole-3-carboxylate
Catalog ID
STK927533
SMILES CCOC(=O)c1c(C)n(c2c1cc(OCC(CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)C)O)cc2)Cc1ccccc1
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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 C33H39N3O6S MW 605.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H39N3O6S/c1-4-41-33(38)32-25(3)36(21-26-8-6-5-7-9-26)31-15-12-28(20-30(31)32)42-23-27(37)22-34-16-18-35(19-17-34)43(39,40)29-13-10-24(2)11-14-29/h5-15,20,27,37H,4,16-19,21-23H2,1-3H3InChIKey
POKPYMDZAHSPQN-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(CN3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C)O)CC5=CC=CC=C5)C
ethyl1benzyl5(2hydroxy3(4((4methylphenyl)sulfonyl)piperazin1yl)propoxy)2methyl1Hindole3carboxylate
ethyl1benzyl5(2hydroxy3(4(4methylphenyl)sulfonylpiperazin1yl)propoxy)2methylindole3carboxylate
ETHYL5(2HYDROXY3(4((4METHYLPHENYL)SULFONYL)PIPERAZINYL)PROPOXY)2METHYL1BENZYLINDOLE3CARBOXYLATE
InChI=1SC33H39N3O6Sc144133(38)3225(3)36(21268657926)31151228(2030(31)32)422327(37)2234161835(191734)43(3940)29131024(2)111429h515202737H416192123H213H3
MFCD04559349
ZINC000098048152
ZINC000098048153
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