Vitas-M small molecule compound
2-(2-{4-[(2E)-3-(thiophen-2-yl)prop-2-enoyl]piperazin-1-yl}ethyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Catalog ID
STK839871
SMILES O=C(N1CCN(CC1)CCn1c(=O)c2cccc3c2c(c1=O)ccc3)/C=C/c1cccs1
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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 C25H23N3O3S MW 445.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O3S/c29-22(10-9-19-6-3-17-32-19)27-14-11-26(12-15-27)13-16-28-24(30)20-7-1-4-18-5-2-8-21(23(18)20)25(28)31/h1-10,17H,11-16H2/b10-9+InChIKey
MQJWOTUIWICXNM-MDZDMXLPSA-NSynonyms
371232-10-9(E)2(2(4(3(thiophen2yl)acryloyl)piperazin1yl)ethyl)1Hbenzo(de)isoquinoline13(2H)dione
2(2(4((2E)3(thiophen2yl)prop2enoyl)piperazin1yl)ethyl)1Hbenzo(de)isoquinoline13(2H)dione
2(2(4((E)3THIOPHEN2YLPROP2ENOYL)PIPERAZIN1YL)ETHYL)BENZO(DE)ISOQUINOLINE13DIONE
371232109
C1CN(CCN1CCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C(=O)C=CC5=CC=CS5
InChI=1SC25H23N3O3Sc2922(1091963173219)27141126(121527)13162824(30)207141852821(23(18)20)25(28)31h11017H1116H2b109+
MFCD02107002
O=C(N1CCN(CC1)CCn1c(=O)c2cccc3c2c(c1=O)ccc3)C=Cc1cccs1
ZINC000019782529
ZINC19782529
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