Vitas-M small molecule compound
ethyl 2-({3-[4-(2-hydroxyethyl)piperazin-1-yl]quinoxalin-2-yl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK538115
SMILES OCCN1CCN(CC1)c1nc2ccccc2nc1Nc1sc2c(c1C(=O)OCC)CCCC2
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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 C25H31N5O3S MW 481.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N5O3S/c1-2-33-25(32)21-17-7-3-6-10-20(17)34-24(21)28-22-23(27-19-9-5-4-8-18(19)26-22)30-13-11-29(12-14-30)15-16-31/h4-5,8-9,31H,2-3,6-7,10-16H2,1H3,(H,26,28)InChIKey
RPMXXCUTDXKJKD-UHFFFAOYSA-NSynonyms
496773-86-5496773865
CCOC(=O)C1=C(SC2=C1CCCC2)NC3=NC4=CC=CC=C4N=C3N5CCN(CC5)CCO
ethyl2((3(4(2hydroxyethyl)piperazin1yl)quinoxalin2yl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((3(4(2hydroxyethyl)piperazin1yl)quinoxalin2yl)amino)4567tetrahydrobenzo(b)thiophene3carboxylate
InChI=1SC25H31N5O3Sc123325(32)21177361020(17)3424(21)282223(2719954818(19)2622)30131129(121430)151631h458931H23671016H21H3(H2628)
MFCD03298617
ZINC000020100590
ZINC20100590
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