Vitas-M small molecule compound
2-{[3-(4-benzylpiperazin-1-yl)quinoxalin-2-yl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Catalog ID
STK540830
SMILES N#Cc1c(Nc2nc3ccccc3nc2N2CCN(CC2)Cc2ccccc2)sc2c1CCCC2
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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 C28H28N6S MW 480.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N6S/c29-18-22-21-10-4-7-13-25(21)35-28(22)32-26-27(31-24-12-6-5-11-23(24)30-26)34-16-14-33(15-17-34)19-20-8-2-1-3-9-20/h1-3,5-6,8-9,11-12H,4,7,10,13-17,19H2,(H,30,32)InChIKey
ZCHMCIYCMCIZTA-UHFFFAOYSA-NSynonyms
371142-77-72((3(4benzylpiperazin1yl)quinoxalin2yl)amino)4567tetrahydro1benzothiophene3carbonitrile
2((3(4benzylpiperazin1yl)quinoxalin2yl)amino)4567tetrahydrobenzo(b)thiophene3carbonitrile
371142777
C1CCC2=C(C1)C(=C(S2)NC3=NC4=CC=CC=C4N=C3N5CCN(CC5)CC6=CC=CC=C6)C#N
InChI=1SC28H28N6Sc2918222110471325(21)3528(22)322627(312412651123(24)3026)34161433(151734)19208213920h1356891112H4710131719H2(H3032)
MFCD03009247
ZINC000057058938
ZINC57058938
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