Vitas-M small molecule compound
ethyl 5-fluoro-3-({2-[(3R)-4-(3-methoxyphenyl)-3-methylpiperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate
Catalog ID
STK538292
SMILES CCOC(=O)c1[nH]c2c(c1NC(=O)C(N1CCN(C(C1)C)c1cccc(c1)OC)C)cc(cc2)F
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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 C26H31FN4O4 MW 482.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31FN4O4/c1-5-35-26(33)24-23(21-13-18(27)9-10-22(21)28-24)29-25(32)17(3)30-11-12-31(16(2)15-30)19-7-6-8-20(14-19)34-4/h6-10,13-14,16-17,28H,5,11-12,15H2,1-4H3,(H,29,32)InChIKey
SABMLPUCQMUYOZ-UHFFFAOYSA-NSynonyms
448192-44-7448192447
CCOC(=O)c1(nH)c2c(c1NC(=O)C(N1CCN(C(C1)C)c1cccc(c1)OC)C)cc(cc2)F
CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)F)NC(=O)C(C)N3CCN(C(C3)C)C4=CC(=CC=C4)OC
ethyl5fluoro3((2((3R)4(3methoxyphenyl)3methylpiperazin1yl)propanoyl)amino)1Hindole2carboxylate
ethyl5fluoro3(2((S)4(3methoxyphenyl)3methylpiperazin1yl)propanamido)1Hindole2carboxylate
ETHYL5FLUORO3(2(4(3METHOXYPHENYL)3METHYLPIPERAZIN1YL)PROPANOYLAMINO)1HINDOLE2CARBOXYLATE
InChI=1SC26H31FN4O4c153526(33)2423(211318(27)91022(21)2824)2925(32)17(3)30111231(16(2)1530)1976820(1419)344h6101314161728H5111215H214H3(H2932)
ZINC000035369247
ZINC000071164228
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