Vitas-M small molecule compound
3-(3-{carboxy[4-(thiophen-2-ylmethyl)piperazin-1-yl]methyl}-5-methoxy-1H-indol-1-yl)propanoic acid
Catalog ID
STK939564
SMILES COc1ccc2c(c1)c(cn2CCC(=O)O)C(N1CCN(CC1)Cc1cccs1)C(=O)O
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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 C23H27N3O5S MW 457.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3O5S/c1-31-16-4-5-20-18(13-16)19(15-26(20)7-6-21(27)28)22(23(29)30)25-10-8-24(9-11-25)14-17-3-2-12-32-17/h2-5,12-13,15,22H,6-11,14H2,1H3,(H,27,28)(H,29,30)InChIKey
QJEVVEJALIVIKF-UHFFFAOYSA-NSynonyms
1214834-92-01214834920
3(3(carboxy(4(thiophen2ylmethyl)piperazin1yl)methyl)5methoxy1Hindol1yl)propanoicacid
3(3(carboxy(4(thiophen2ylmethyl)piperazin1yl)methyl)5methoxyindol1yl)propanoicacid
COC1=CC2=C(C=C1)N(C=C2C(C(=O)O)N3CCN(CC3)CC4=CC=CS4)CCC(=O)O
InChI=1SC23H27N3O5Sc13116452018(1316)19(1526(20)7621(27)28)22(23(29)30)2510824(91125)141732123217h2512131522H61114H21H3(H2728)(H2930)
MFCD13756437
ZINC000036354760
ZINC000036354761
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